data_6d74_residue ############################ # Computer software used # ############################ 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 6d74 _Structure_validation_residue.Date_analyzed 2019-05-10 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 112.855 0.687 . . . . 75.32 112.855 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.69 -37.51 87.63 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.303 0.641 . . . . 71.44 110.441 -174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.641 ' HG ' ' SD ' ' A' ' 62' ' ' MET . 7.4 tt -62.46 -40.73 97.59 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.837 -1.074 . . . . 74.52 109.836 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.64 -32.0 71.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.692 0.797 . . . . 74.44 110.519 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -63.98 -40.01 95.42 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 119.336 -0.364 . . . . 75.5 110.659 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' A' ' 65' ' ' PHE . 29.4 mt -59.51 -46.05 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 CA-C-O 120.979 0.419 . . . . 74.12 110.493 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.401 HG12 ' O ' ' A' ' 4' ' ' LEU . 46.1 mm -61.98 -45.7 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.101 -0.954 . . . . 75.31 111.139 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.7 m -62.75 -53.04 60.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.791 0.836 . . . . 65.44 110.248 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.6 mt -50.13 -47.24 54.22 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 124.487 1.117 . . . . 73.53 110.221 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.434 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -58.42 -52.81 50.56 Favored Glycine 0 C--N 1.342 0.877 0 O-C-N 124.243 0.964 . . . . 75.14 113.809 -175.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.0 -40.28 94.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.585 0.354 . . . . 73.12 111.286 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.486 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 65.2 t -64.91 -38.52 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 115.798 -0.637 . . . . 64.3 110.825 176.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.523 HD11 ' O ' ' A' ' 69' ' ' LEU . 20.1 mt -63.65 -51.46 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.45 1.1 . . . . 74.02 110.079 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.508 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 69.8 t60 -54.91 -46.76 74.92 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.46 1.1 . . . . 73.31 109.632 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.1 tptm -62.63 -53.71 50.51 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 124.505 1.128 . . . . 73.43 111.91 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.6 ptp180 -74.48 -22.67 58.97 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.792 0.437 . . . . 71.5 111.772 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.508 ' SG ' HD21 ' A' ' 31' ' ' LEU . 52.4 t -67.0 -26.0 66.58 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.609 0.364 . . . . 74.12 111.292 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 15' ' ' HIS . 44.4 mt-10 -74.32 5.72 4.3 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 112.966 0.728 . . . . 74.14 112.966 -175.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.49 ' HG3' ' NH1' ' A' ' 82' ' ' ARG . 14.8 pt-20 -86.15 -13.85 45.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.687 0.395 . . . . 74.34 111.439 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.531 ' HA ' ' HD2' ' A' ' 82' ' ' ARG . 14.2 mmt -76.24 95.07 3.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.846 0.458 . . . . 73.43 110.452 -176.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -73.07 -32.64 65.14 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.321 0.582 . . . . 74.24 109.937 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -94.61 153.8 17.67 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.335 -0.987 . . . . 71.14 108.335 166.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.543 ' SG ' HD11 ' A' ' 97' ' ' LEU . 95.3 m 60.51 55.33 3.46 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 124.131 0.894 . . . . 70.11 110.342 -170.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.81 -48.2 59.96 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.183 -0.917 . . . . 74.4 111.022 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.522 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.3 mtpm? -72.7 -32.99 66.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.881 0.472 . . . . 74.44 110.421 -173.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.534 ' HG2' HH12 ' A' ' 30' ' ' ARG . 48.0 mt-30 -71.64 -31.09 66.47 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.368 0.267 . . . . 74.44 111.174 172.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.6 t -67.41 -39.44 85.53 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.257 0.623 . . . . 63.54 110.532 173.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -74.4 -32.12 62.59 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 114.849 -1.069 . . . . 74.31 110.749 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.534 HH12 ' HG2' ' A' ' 27' ' ' GLN . 40.0 ttp-105 -77.61 -39.91 43.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.32 0.648 . . . . 74.41 110.205 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.508 HD21 ' SG ' ' A' ' 18' ' ' CYS . 61.6 tp -61.25 -47.14 87.38 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.713 -0.847 . . . . 74.32 108.713 172.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.37 -41.09 98.34 Favored Glycine 0 C--N 1.351 1.415 0 O-C-N 123.928 0.767 . . . . 72.32 113.004 176.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -59.98 -51.85 67.92 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.063 0.945 . . . . 74.44 110.677 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.581 ' NH2' ' HB3' ' A' ' 133' ' ' TRP . 34.9 mtt180 -59.78 -62.39 1.91 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.201 -1.363 . . . . 75.34 110.632 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.4 t -51.13 -46.31 31.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 124.453 1.096 . . . . 55.44 111.951 -173.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.491 HD23 HD13 ' A' ' 39' ' ' ILE . 94.7 mt -67.46 -44.25 79.1 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.415 0.447 . . . . 64.2 110.745 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.38 -19.44 62.13 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.266 0.354 . . . . 75.33 113.741 175.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 81.0 mt -86.69 -52.58 5.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.825 0.85 . . . . 72.31 111.995 177.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.491 HD13 HD23 ' A' ' 36' ' ' LEU . 12.7 pt -73.99 -46.69 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 118.758 -0.639 . . . . 73.42 111.769 -169.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.489 ' HE2' ' HB3' ' A' ' 36' ' ' LEU . 68.3 mttm -53.57 -50.22 84.38 Favored Pre-proline 0 N--CA 1.489 1.506 0 CA-C-O 118.416 -0.802 . . . . 74.13 113.094 -173.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.414 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.4 Cg_exo -55.87 -54.02 4.7 Favored 'Trans proline' 0 C--N 1.395 3.005 0 C-N-CA 121.963 1.775 . . . . 64.32 112.045 176.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 45' ' ' LEU . 4.3 mm? -64.39 -23.36 67.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.488 0.715 . . . . 75.33 111.647 -176.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 45.7 mt-10 -71.65 -44.18 64.77 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.739 0.816 . . . . 74.43 110.572 172.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 32.7 mmt -69.55 -26.89 64.71 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.529 0.518 . . . . 73.25 110.983 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 42' ' ' LEU . 39.2 mt -78.61 -37.14 43.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 64.03 109.987 176.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -68.84 -32.63 72.45 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 115.648 -0.705 . . . . 73.52 110.123 174.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 124.404 1.082 . . . . 73.35 110.907 -179.208 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.418 ' H ' HD13 ' A' ' 58' ' ' LEU . 4.5 m . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 110.609 -0.145 . . . . 74.11 110.609 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.06 -42.73 77.09 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.796 0.438 . . . . 63.33 110.075 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.53 -45.68 88.38 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.09 -0.959 . . . . 71.3 111.75 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 97.6 mt -74.14 -37.08 64.15 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.816 0.846 . . . . 72.23 111.115 -172.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 67.0 m -62.6 -55.46 26.9 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.95 0.781 . . . . 72.24 109.203 175.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 26.4 m -62.89 -36.03 81.97 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.755 -0.657 . . . . 74.41 111.246 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.467 ' HB2' HD13 ' A' ' 112' ' ' LEU . . . -64.08 -48.93 74.27 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.388 0.675 . . . . 73.14 111.016 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.641 ' SD ' ' HG ' ' A' ' 4' ' ' LEU . 32.8 mmt -68.54 -30.08 68.79 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.548 -0.751 . . . . 72.34 111.992 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -76.37 -36.72 57.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.537 0.335 . . . . 75.44 111.165 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -67.41 -41.92 84.1 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.604 0.762 . . . . 71.45 109.512 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.546 ' HB3' HD11 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -67.03 -49.41 65.32 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.364 -0.834 . . . . 75.11 109.511 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.3 ttpp -53.59 -51.69 62.19 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.619 0.574 . . . . 73.1 110.267 178.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.98 89.51 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.263 0.977 . . . . 74.13 112.093 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.493 ' HB2' HD13 ' A' ' 105' ' ' LEU . . . -63.97 -44.5 92.56 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.755 0.822 . . . . 62.32 111.102 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.523 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -69.77 -29.45 66.79 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.247 -0.888 . . . . 75.42 110.708 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.7 mt-10 -65.76 -38.48 89.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.584 -0.697 . . . . 61.14 109.856 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.407 ' HB2' HG12 ' A' ' 101' ' ' VAL . 44.0 mt-10 -61.84 -52.2 65.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.45 -0.795 . . . . 73.42 110.144 174.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.7 79.93 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 123.876 0.735 . . . . 74.11 111.367 -178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -59.64 -48.3 82.2 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.698 1.199 . . . . 71.14 110.645 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.23 91.71 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.195 -0.911 . . . . 71.32 113.18 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -67.77 -54.01 22.65 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 119.073 -0.489 . . . . 73.24 110.95 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.411 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.4 OUTLIER -63.31 -33.71 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 112.02 0.378 . . . . 73.2 112.02 177.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.16 -33.22 75.5 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 120.973 0.416 . . . . 71.53 110.262 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -80.73 -27.78 36.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.5 0.72 . . . . 62.04 110.855 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.3 m-85 -87.1 9.4 19.96 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.004 0.922 . . . . 73.45 111.32 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -57.16 -16.79 8.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.073 0.949 . . . . 72.43 112.306 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -110.3 115.14 29.15 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 108.027 -1.101 . . . . 74.0 108.027 167.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.531 ' HD2' ' HA ' ' A' ' 21' ' ' MET . 1.0 OUTLIER -72.82 -24.65 60.93 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.423 0.689 . . . . 71.23 111.373 178.652 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 p -64.95 -37.47 87.75 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.311 0.644 . . . . 72.23 110.326 170.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.79 -38.28 86.21 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.856 0.862 . . . . 65.32 110.601 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.525 HG21 ' HG ' ' A' ' 24' ' ' CYS . 36.2 mt -57.7 -49.16 81.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 108.862 -0.792 . . . . 74.12 108.862 175.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.01 -35.08 79.02 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.425 0.453 . . . . 74.15 111.606 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -60.8 -45.11 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.699 0.624 . . . . 74.42 111.054 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.403 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -80.54 -27.51 37.56 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 110.384 -0.228 . . . . 71.4 110.384 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 14.6 tp -67.61 -44.25 78.5 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.518 1.127 . . . . 74.2 111.164 -171.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -65.63 -13.58 59.41 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.868 -1.06 . . . . 74.31 111.65 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.26 -21.75 12.4 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.082 0.953 . . . . 74.31 111.402 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 123.948 0.899 . . . . 74.33 110.147 -175.623 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 7.0 mt . . . . . 0 C--O 1.242 0.696 0 N-CA-C 108.259 -1.015 . . . . 75.15 108.259 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.543 HD11 ' SG ' ' A' ' 24' ' ' CYS . 20.2 mt -65.87 -54.1 31.11 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 122.142 0.972 . . . . 73.31 109.621 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.468 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 21.9 m-85 -94.44 36.72 1.14 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.628 -1.624 . . . . 74.24 109.947 -174.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.557 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 1.6 tmmt? -52.53 -62.46 1.63 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.152 0.433 . . . . 74.35 110.844 -176.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -61.85 -60.84 3.05 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.262 0.625 . . . . 74.43 110.802 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.407 HG12 ' HB2' ' A' ' 71' ' ' GLU . 77.9 t -50.34 -57.85 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.898 1.279 . . . . 75.42 112.807 -174.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.458 ' HA ' HD12 ' A' ' 105' ' ' LEU . 65.3 t30 -73.83 -22.25 59.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.985 -1.007 . . . . 64.44 110.349 -174.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.1 -43.65 95.39 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.203 -0.427 . . . . 74.44 110.126 166.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -56.75 -46.91 81.11 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 119.386 -0.34 . . . . 74.32 110.665 172.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 68' ' ' ALA . 9.9 mp -53.21 -41.66 65.55 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 117.784 0.265 . . . . 62.11 111.142 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.451 ' HA ' ' HE3' ' A' ' 133' ' ' TRP . 38.9 t -67.53 -43.94 79.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.884 0.874 . . . . 53.42 111.577 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 68.7 m-20 -69.79 -55.16 10.59 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.411 -0.813 . . . . 73.22 110.243 -177.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.7 t -63.28 -32.75 57.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 119.532 -0.271 . . . . 71.32 111.225 -176.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -67.46 -48.18 67.95 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.02 -0.514 . . . . 74.44 111.738 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 41.4 pttt -60.72 -42.09 96.58 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 109.327 -0.62 . . . . 74.44 109.327 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.39 -35.56 75.91 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.391 1.076 . . . . 71.53 110.607 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.467 HD13 ' HB2' ' A' ' 61' ' ' ALA . 0.3 OUTLIER -61.14 -59.81 4.74 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 107.948 -1.131 . . . . 75.14 107.948 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.9 t -53.97 -35.49 61.87 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.905 -1.498 . . . . 71.43 110.973 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.2 mt -63.22 -62.95 1.35 Allowed 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.154 0.582 . . . . 72.44 111.533 172.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.455 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 3.8 pp -63.19 -28.61 70.16 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.134 0.42 . . . . 73.13 112.134 -173.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 91.7 mt -65.28 -57.9 7.28 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.292 -0.867 . . . . 72.34 109.878 173.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -68.17 -23.72 64.89 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 112.18 0.437 . . . . 72.34 112.18 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 85.4 t -83.94 -63.96 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.376 0.271 . . . . 75.33 111.003 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -93.87 -44.48 8.08 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 122.253 -0.279 . . . . 64.15 111.537 -170.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -71.21 -17.63 62.51 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 116.674 -0.239 . . . . 73.15 110.481 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 65.82 9.73 6.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.741 1.617 . . . . 74.21 111.363 -177.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 33.1 ttp -94.61 111.12 52.81 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.476 1.11 . . . . 75.35 109.432 -170.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 C--N 1.366 1.465 0 C-N-CA 124.004 3.136 . . . . 72.24 112.915 -165.138 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.581 ' HB3' ' NH2' ' A' ' 34' ' ' ARG . 12.3 m0 . . . . . 0 CA--C 1.548 0.881 0 N-CA-C 113.983 1.105 . . . . 75.53 113.983 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.35 93.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.289 0.236 . . . . 65.13 110.792 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -72.58 -32.34 65.93 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.393 0.677 . . . . 64.15 111.319 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.493 ' HG2' ' HD2' ' A' ' 30' ' ' ARG . 29.4 tt0 -61.99 -58.67 6.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.694 0.798 . . . . 75.32 109.973 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -37.83 83.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.061 0.544 . . . . 75.1 111.835 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -56.01 -63.76 1.08 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.79 0.681 . . . . 73.4 110.948 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -71.46 -46.19 60.6 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.524 0.515 . . . . 73.44 110.862 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.94 -43.01 72.48 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.923 -0.58 . . . . 61.44 111.129 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.418 ' HB3' HG12 ' A' ' 96' ' ' ILE . . . -78.05 -25.36 47.71 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 123.212 0.32 . . . . 75.32 111.096 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.21 -53.72 55.1 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.318 -0.623 . . . . 70.22 109.318 170.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -58.65 -44.61 90.16 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 114.341 -1.3 . . . . 72.41 111.693 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.522 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 34.0 t70 -80.88 -32.25 34.97 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.952 0.782 . . . . 72.43 112.87 -168.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -70.2 -41.33 73.82 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.288 -1.005 . . . . 74.44 108.288 174.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 ttm180 -62.42 -37.44 85.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 114.726 -1.124 . . . . 73.23 109.954 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.87 -17.82 59.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.438 0.695 . . . . 73.34 111.396 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.487 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 1.6 t80 -69.98 -59.81 2.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.238 -1.023 . . . . 70.44 108.238 171.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.92 -38.65 72.95 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 113.874 -1.512 . . . . 74.12 111.595 -170.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 87.4 mmm -103.55 31.7 4.25 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.196 0.999 . . . . 74.34 110.131 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 C--N 1.36 1.035 0 CA-C-O 121.583 0.706 . . . . 73.03 109.574 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 119.772 -0.156 . . . . 64.44 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -59.65 -35.03 73.6 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.784 0.677 . . . . 73.44 111.562 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 30.5 tp -66.71 -44.56 81.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.888 0.475 . . . . 73.11 110.549 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -70.21 -25.35 63.36 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.791 0.436 . . . . 74.23 110.633 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -77.64 -29.96 51.98 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-O 118.993 -0.527 . . . . 72.13 110.768 173.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.46 -44.91 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 109.2 -0.667 . . . . 74.43 109.2 170.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 mm -60.42 -51.52 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-N 114.5 -1.227 . . . . 64.54 110.842 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.8 m -65.09 -56.77 11.09 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.329 0.652 . . . . 70.15 111.075 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.2 mt -51.7 -51.54 55.22 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.965 0.906 . . . . 73.5 111.199 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.26 -35.24 90.06 Favored Glycine 0 C--N 1.346 1.126 0 O-C-N 124.272 0.983 . . . . 74.12 114.05 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -69.16 -42.8 75.44 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.22 0.533 . . . . 65.13 109.729 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.439 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 62.8 t -62.06 -37.72 79.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-N 114.923 -1.035 . . . . 74.21 110.139 174.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.408 HG23 HG22 ' A' ' 35' ' ' VAL . 32.8 mt -58.04 -52.21 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.758 0.823 . . . . 74.33 110.131 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -60.16 -36.29 77.23 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.004 0.815 . . . . 73.32 110.982 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -66.29 -66.98 0.48 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 119.541 -0.266 . . . . 75.41 111.454 175.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -63.78 -20.17 65.56 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.355 0.872 . . . . 73.25 113.355 -172.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.5 t -65.33 -20.53 66.44 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.067 0.547 . . . . 72.21 112.077 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.28 -18.07 24.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.781 0.832 . . . . 65.23 113.07 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -65.85 -21.51 66.47 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.337 0.866 . . . . 74.54 113.337 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.529 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 7.6 mmt -75.57 87.7 2.68 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 121.16 0.505 . . . . 75.54 110.493 -173.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -35.59 63.79 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.787 -1.097 . . . . 72.3 108.447 170.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.424 ' O ' ' SG ' ' A' ' 24' ' ' CYS . 48.0 m-85 -92.64 152.89 19.31 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 108.129 -1.063 . . . . 74.21 108.129 169.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 23' ' ' TYR . 31.5 p 50.54 60.11 4.09 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.243 1.017 . . . . 72.35 110.413 -171.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 47.4 mtmt -66.58 -45.32 79.62 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 114.491 -1.231 . . . . 72.01 111.371 -174.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -71.42 -36.8 71.43 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 108.194 -1.039 . . . . 74.1 108.194 -170.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -43.86 79.94 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.066 1.346 . . . . 75.44 112.231 169.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 32.8 t -60.94 -39.79 90.83 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.683 0.793 . . . . 72.34 110.889 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.9 mpt_? -81.23 -22.44 38.76 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.628 0.771 . . . . 74.54 111.1 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.45 -60.45 2.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.632 0.773 . . . . 74.25 109.166 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 29.0 tp -58.23 -40.52 81.9 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.425 1.09 . . . . 73.43 110.196 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.04 -51.04 59.73 Favored Glycine 0 C--N 1.354 1.54 0 O-C-N 123.965 0.791 . . . . 71.15 112.458 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -71.59 -32.99 68.65 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.082 0.553 . . . . 74.4 111.387 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.768 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.9 mtt180 -62.37 -63.58 1.19 Allowed 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.419 0.449 . . . . 71.35 109.812 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.408 HG22 HG23 ' A' ' 14' ' ' ILE . 99.8 t -65.09 -41.14 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.549 -0.75 . . . . 72.44 111.219 -173.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.8 -40.94 98.9 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.344 0.592 . . . . 73.31 109.893 175.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.1 -22.09 75.84 Favored Glycine 0 C--O 1.216 -1.006 0 CA-C-N 114.702 -1.135 . . . . 70.05 113.083 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 90.5 mt -84.42 -39.7 18.68 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 117.838 0.819 . . . . 72.34 111.372 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 pt -81.66 -39.18 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 112.447 0.536 . . . . 74.53 112.447 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 44' ' ' MET . 31.2 mmtp -60.07 -53.79 61.7 Favored Pre-proline 0 N--CA 1.485 1.304 0 CA-C-O 118.004 -0.998 . . . . 74.13 112.518 -174.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 27.2 Cg_endo -60.17 -41.26 52.95 Favored 'Trans proline' 0 C--N 1.399 3.222 0 C-N-CA 122.08 1.853 . . . . 72.23 110.539 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.452 HD12 HD12 ' A' ' 45' ' ' LEU . 3.9 mm? -60.67 -35.66 76.8 Favored 'General case' 0 C--N 1.356 0.868 0 O-C-N 124.286 0.991 . . . . 75.21 111.667 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.16 -44.9 67.84 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.798 0.439 . . . . 73.43 110.943 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.447 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 36.2 mmt -57.13 -51.76 68.02 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.099 0.874 . . . . 75.23 110.265 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 41' ' ' PRO . 3.5 pp -77.16 -27.5 53.82 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.203 -0.453 . . . . 74.34 111.721 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -59.45 -39.14 82.64 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.654 0.661 . . . . 72.44 110.153 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 CA--C 1.544 0.723 0 CA-C-N 115.157 -0.929 . . . . 73.2 111.562 -177.78 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 p . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 110.321 -0.251 . . . . 70.11 110.321 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -57.09 -51.33 69.74 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.15 0.58 . . . . 73.13 110.918 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.25 62.39 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.33 -0.85 . . . . 72.45 111.883 -179.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.519 HD11 HD12 ' A' ' 115' ' ' LEU . 52.8 tp -72.55 -43.6 63.25 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.885 -0.413 . . . . 71.44 109.885 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.3 m -62.17 -49.68 74.85 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 123.787 0.835 . . . . 74.11 109.36 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 54.8 m -54.71 -44.93 73.89 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.038 0.935 . . . . 74.13 110.826 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' A' ' 112' ' ' LEU . . . -65.89 -38.57 89.09 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.634 0.774 . . . . 63.52 111.198 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.82 -30.44 66.87 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.914 0.485 . . . . 73.44 111.007 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -68.33 -45.99 71.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.039 0.536 . . . . 74.11 109.87 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -67.91 -39.38 83.58 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.469 -0.787 . . . . 74.52 111.32 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.403 ' CZ ' HD13 ' A' ' 38' ' ' LEU . 1.2 t80 -68.47 -46.42 69.81 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.154 0.982 . . . . 73.31 109.531 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -60.94 -44.83 96.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.894 1.278 . . . . 74.45 111.036 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.3 -38.47 90.31 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.235 0.614 . . . . 74.42 111.083 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.478 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -66.85 -33.93 76.68 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.335 -0.848 . . . . 64.45 110.947 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.74 -35.82 75.31 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.944 -0.571 . . . . 75.11 110.994 174.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.07 -38.56 91.51 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 122.951 0.5 . . . . 75.52 110.981 176.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.24 -51.4 67.91 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 123.959 0.787 . . . . 74.3 109.943 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.63 -35.85 79.08 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.597 0.759 . . . . 62.41 111.537 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -69.05 -41.58 77.45 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.773 1.229 . . . . 72.21 110.358 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.08 -33.8 65.04 Favored Glycine 0 C--N 1.347 1.171 0 CA-C-N 115.109 -0.951 . . . . 61.12 112.224 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -62.69 -50.85 69.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.089 0.556 . . . . 52.12 111.408 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.55 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -71.98 -28.01 28.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 112.231 0.456 . . . . 73.23 112.231 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.435 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 39.5 tt0 -62.83 -36.72 84.13 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.668 0.747 . . . . 61.45 109.583 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -77.8 -39.13 44.9 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 114.359 -1.291 . . . . 74.52 110.698 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.55 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 15.1 m-30 -76.59 -3.52 38.06 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 124.309 1.044 . . . . 74.23 112.081 -177.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.4 p -56.04 -31.36 63.06 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 121.507 0.67 . . . . 74.34 109.765 171.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.21 104.64 16.56 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.438 -1.319 . . . . 73.41 107.438 166.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -22.43 64.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.417 0.687 . . . . 75.3 110.724 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.7 m -58.62 -39.4 80.36 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.305 1.042 . . . . 65.3 110.966 170.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.13 -41.38 97.23 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 124.151 0.98 . . . . 70.42 110.818 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 29.0 mt -58.78 -51.17 75.35 Favored 'Isoleucine or valine' 0 C--N 1.362 1.11 0 O-C-N 123.956 0.785 . . . . 74.1 109.402 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 48.3 t -55.67 -46.18 77.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.88 0.872 . . . . 64.12 111.522 178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -59.32 -42.96 92.64 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.662 -1.154 . . . . 73.41 111.832 -176.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -24.89 27.48 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 119.305 -0.379 . . . . 73.34 110.513 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 16.5 tp -67.46 -39.27 85.32 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.493 0.717 . . . . 72.11 110.859 -172.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.8 t -65.81 -26.15 67.55 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 115.363 -0.835 . . . . 74.21 111.18 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.15 -3.99 30.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.157 0.983 . . . . 73.12 111.64 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 109.633 -0.506 . . . . 75.34 109.633 -175.415 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 108.858 -0.793 . . . . 74.21 108.858 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.1 mt -61.95 -43.65 98.4 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.829 0.823 . . . . 72.24 110.41 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -105.58 45.31 0.98 Allowed 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.143 -1.39 . . . . 74.25 108.933 -177.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.15 -66.72 0.35 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 118.483 0.583 . . . . 72.52 110.35 -170.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.412 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 36.1 t70 -73.07 -41.04 64.55 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.713 0.633 . . . . 74.13 111.028 -176.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.42 -58.56 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 123.839 0.712 . . . . 75.4 110.902 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -74.95 -20.79 59.53 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.979 0.912 . . . . 74.22 111.274 -176.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -64.42 -37.12 86.42 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 108.936 -0.765 . . . . 74.3 108.936 167.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 61.1 mtpt -71.75 -37.01 70.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.2 0.6 . . . . 75.32 110.721 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.478 HD11 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -58.35 -47.44 83.78 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.938 -0.393 . . . . 74.22 109.938 171.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.768 ' HB2' HH12 ' A' ' 34' ' ' ARG . 35.1 t -66.55 -38.97 88.25 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.744 0.818 . . . . 75.44 111.362 -177.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.746 ' HA ' ' HE3' ' A' ' 110' ' ' LYS . 39.1 t70 -69.4 -55.46 10.28 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.007 0.923 . . . . 62.11 110.197 -175.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.44 -22.84 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-N 115.22 -0.9 . . . . 71.5 110.598 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -70.56 -38.14 74.1 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 118.907 -0.568 . . . . 72.2 111.153 171.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.746 ' HE3' ' HA ' ' A' ' 107' ' ' ASP . 10.0 mtmp? -58.92 -47.3 85.49 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 118.536 0.607 . . . . 72.21 110.085 172.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 12.6 mm-40 -58.02 -49.87 75.37 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.329 1.018 . . . . 74.4 110.332 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 61' ' ' ALA . 0.8 OUTLIER -54.75 -61.72 2.13 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 124.258 0.974 . . . . 71.25 109.727 176.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -53.47 -39.59 64.63 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.541 1.136 . . . . 65.55 112.091 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.56 -60.41 3.38 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.969 0.507 . . . . 73.35 111.125 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.519 HD12 HD11 ' A' ' 58' ' ' LEU . 4.1 pp -65.26 -37.16 86.36 Favored 'General case' 0 CA--C 1.559 1.297 0 CA-C-O 120.877 0.37 . . . . 65.5 111.492 -173.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.635 HD21 ' SD ' ' A' ' 122' ' ' MET . 95.1 mt -65.39 -49.11 70.52 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.185 0.994 . . . . 75.45 111.131 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -73.83 -40.06 63.6 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 112.454 0.538 . . . . 72.31 112.454 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 78.9 t -71.5 -53.56 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 122.582 0.353 . . . . 71.35 111.06 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -87.66 -57.68 2.85 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.079 0.466 . . . . 64.43 111.284 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -84.66 -13.2 52.2 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.348 -0.842 . . . . 73.21 111.336 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 60.82 35.32 19.47 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 124.765 1.226 . . . . 74.23 112.016 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.635 ' SD ' HD21 ' A' ' 116' ' ' LEU . 42.4 mtp -78.06 112.77 27.76 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 115.262 -0.881 . . . . 75.34 109.952 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo . . . . . 0 C--N 1.369 1.647 0 C-N-CA 122.703 2.269 . . . . 75.21 110.637 -179.094 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.871 0 N-CA-C 111.752 0.279 . . . . 74.11 111.752 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.42 -40.37 57.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.325 0.65 . . . . 71.25 111.282 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -64.24 -39.26 93.59 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.791 0.836 . . . . 75.1 110.668 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -52.16 -57.05 10.81 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 124.6 1.188 . . . . 75.21 110.881 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -69.25 -35.71 76.39 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 124.343 1.027 . . . . 75.3 113.542 -171.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.1 -37.56 69.53 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 118.558 0.617 . . . . 72.44 111.049 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -75.73 -36.35 59.95 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.417 0.627 . . . . 71.02 110.517 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 143' ' ' GLU . 14.2 t70 -62.18 -48.49 79.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.235 1.414 . . . . 75.33 109.838 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.86 -24.34 58.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.235 -1.348 . . . . 72.31 112.205 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.97 -45.76 93.46 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.861 -0.792 . . . . 75.15 108.861 168.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 140' ' ' ASP . 22.2 mm-40 -57.9 -54.16 50.08 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.182 -0.917 . . . . 75.04 111.291 175.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -62.09 -45.44 93.49 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 123.783 0.677 . . . . 72.54 112.5 -176.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -56.59 -54.3 47.53 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.768 0.827 . . . . 74.23 110.886 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -71.9 -30.22 65.14 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.834 -0.621 . . . . 70.02 111.308 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.47 -25.4 59.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.089 0.556 . . . . 72.02 110.957 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -57.8 3.59 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.263 0.625 . . . . 70.33 109.585 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . 0.413 ' NE2' HD23 ' A' ' 89' ' ' LEU . 25.5 mm-40 -62.72 -52.14 64.42 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.352 -0.84 . . . . 64.22 110.65 -175.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 96.0 mmm -100.62 79.33 2.08 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.542 -1.281 . . . . 72.41 107.542 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 31.5 tp . . . . . 0 CA--C 1.536 0.406 0 CA-C-N 115.375 -0.829 . . . . 74.31 109.65 -178.924 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.128 -0.323 . . . . 75.32 110.128 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -70.44 -55.47 8.93 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.701 -0.851 . . . . 73.21 108.701 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.07 -32.21 70.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.145 0.903 . . . . 72.23 112.153 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -61.48 -53.37 57.28 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 109.398 -0.593 . . . . 71.31 109.398 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -67.66 -36.45 80.75 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 123.828 0.705 . . . . 71.02 111.469 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.0 mt -56.89 -54.14 33.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.813 0.845 . . . . 64.24 110.843 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 42.1 mm -67.21 -38.97 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 115.085 -0.961 . . . . 70.42 110.94 -177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.0 m -62.61 -47.39 83.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.279 0.632 . . . . 71.03 110.552 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.11 -60.63 3.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.659 0.783 . . . . 73.33 110.09 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.78 -41.22 95.85 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 124.515 1.134 . . . . 61.04 113.898 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.419 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 5.9 tp-100 -61.03 -56.15 24.36 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.649 -0.5 . . . . 73.54 109.649 178.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.461 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 85.3 t -62.98 -27.65 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 CA-C-N 115.263 -0.88 . . . . 75.13 111.393 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.465 HD13 ' O ' ' A' ' 69' ' ' LEU . 27.7 mt -60.93 -54.14 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.751 0.82 . . . . 75.21 109.618 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -58.15 -39.97 80.17 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 124.091 0.869 . . . . 74.11 110.508 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.4 mptm? -61.52 -51.43 68.65 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 123.826 0.704 . . . . 74.45 112.408 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 14.7 ptp180 -81.81 -15.71 53.27 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.411 0.523 . . . . 75.22 112.411 -176.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.619 ' SG ' HD22 ' A' ' 31' ' ' LEU . 45.4 t -69.69 -23.52 63.45 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.355 0.662 . . . . 71.24 110.829 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -65.17 -11.06 36.44 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.772 0.429 . . . . 72.51 112.127 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -30.58 71.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.47 0.708 . . . . 74.54 111.849 173.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.2 mmt -67.91 89.42 0.28 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.154 0.502 . . . . 65.44 111.401 -172.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.61 -20.26 61.32 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.709 -1.132 . . . . 74.1 110.574 169.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -121.19 147.82 45.09 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.362 1.065 . . . . 63.35 108.396 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.571 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 96.8 m 59.09 59.06 2.88 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 124.812 1.32 . . . . 75.14 110.337 -166.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 26' ' ' LYS . 44.1 pttt -70.29 -40.14 74.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.174 -1.376 . . . . 73.22 111.782 -174.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' N ' ' HG3' ' A' ' 25' ' ' LYS . 60.1 tttm -78.02 -34.83 50.48 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.37 0.268 . . . . 73.15 110.305 -170.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -76.1 -25.48 55.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.339 0.656 . . . . 74.24 111.023 174.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 38.4 t -69.7 -44.27 70.73 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.743 0.817 . . . . 55.23 110.766 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.84 -33.3 70.52 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.635 0.774 . . . . 75.11 110.484 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.78 -44.33 93.71 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.56 0.744 . . . . 75.13 110.009 175.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.619 HD22 ' SG ' ' A' ' 18' ' ' CYS . 25.5 tp -59.1 -44.88 91.99 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 109.111 -0.699 . . . . 74.34 109.111 172.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.93 -47.53 88.32 Favored Glycine 0 C--N 1.353 1.486 0 O-C-N 124.148 0.905 . . . . 71.34 113.533 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -66.2 -39.68 89.83 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.181 0.592 . . . . 73.04 111.268 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.541 HH12 ' HB2' ' A' ' 106' ' ' SER . 36.5 mtt180 -61.3 -62.01 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.408 0.443 . . . . 72.13 110.478 174.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 64.9 t -53.88 -41.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.627 1.171 . . . . 45.44 112.225 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.467 HD22 HD13 ' A' ' 39' ' ' ILE . 95.9 mt -68.64 -39.82 80.55 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.516 0.326 . . . . 73.42 110.611 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.07 -19.26 65.72 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-N 116.744 -0.207 . . . . 74.11 113.151 173.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.509 HD11 ' O ' ' A' ' 34' ' ' ARG . 5.2 mp -84.41 -53.53 5.39 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.452 1.101 . . . . 73.21 111.103 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.467 HD13 HD22 ' A' ' 36' ' ' LEU . 15.2 pt -83.69 -42.81 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 118.404 -0.808 . . . . 71.34 112.328 -168.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 44' ' ' MET . 55.1 mtmt -52.41 -53.23 55.48 Favored Pre-proline 0 N--CA 1.49 1.552 0 CA-C-O 118.116 -0.945 . . . . 73.04 112.853 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.73 -43.22 51.85 Favored 'Trans proline' 0 C--N 1.398 3.146 0 C-N-CA 122.175 1.917 . . . . 74.44 111.7 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.15 -29.08 67.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.322 -0.853 . . . . 72.32 112.081 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 51.1 mt-10 -76.0 -38.06 57.76 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.661 0.785 . . . . 71.34 110.474 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 26.4 mmt -62.63 -36.31 82.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.596 -0.729 . . . . 74.5 110.111 177.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -80.6 -33.73 35.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.719 0.808 . . . . 72.1 111.042 176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.02 -32.93 74.7 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.563 1.145 . . . . 75.03 111.223 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.5 t70 . . . . . 0 C--N 1.357 0.901 0 O-C-N 124.046 0.842 . . . . 74.33 110.886 -179.599 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 109.605 -0.517 . . . . 71.44 109.605 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.51 -39.47 83.95 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.083 0.553 . . . . 54.52 111.681 -174.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -71.41 -36.03 71.2 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.673 0.789 . . . . 74.21 111.807 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.54 -46.07 87.67 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.211 -1.033 . . . . 75.44 108.211 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.5 m -69.28 -40.27 77.84 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 114.348 -1.296 . . . . 74.44 110.873 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.6 m -60.32 -43.15 96.65 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.268 0.627 . . . . 70.23 110.811 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.64 88.97 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 123.778 0.673 . . . . 64.15 109.998 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.448 ' SD ' HD13 ' A' ' 112' ' ' LEU . 26.3 mmt -64.27 -25.07 67.89 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.266 -0.879 . . . . 75.11 112.362 176.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.54 -44.13 29.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.287 0.635 . . . . 74.44 110.693 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -59.18 -45.09 91.94 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.875 0.734 . . . . 74.45 109.401 175.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -61.18 -50.76 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 113.245 -1.798 . . . . 65.34 110.746 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -58.56 -48.65 80.22 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.939 1.296 . . . . 75.14 110.624 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.28 -39.39 93.84 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.351 0.661 . . . . 74.2 111.743 -177.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.414 ' HB3' HD12 ' A' ' 105' ' ' LEU . . . -69.72 -34.3 73.69 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.707 -0.679 . . . . 72.22 110.911 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 14' ' ' ILE . 89.8 mt -69.48 -34.09 73.84 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.732 0.413 . . . . 74.02 110.74 174.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.77 -40.57 97.0 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.834 0.35 . . . . 74.51 110.751 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.88 -39.97 87.67 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.67 -0.695 . . . . 71.13 111.175 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.26 -39.32 89.39 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.258 0.623 . . . . 75.42 110.998 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -62.43 -44.56 96.13 Favored 'General case' 0 C--N 1.351 0.65 0 O-C-N 124.565 1.166 . . . . 73.52 109.38 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.6 -36.8 93.82 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.781 -0.645 . . . . 72.52 112.957 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.34 -52.93 63.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.69 0.396 . . . . 74.01 110.884 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.411 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -66.75 -26.48 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 112.73 0.641 . . . . 73.42 112.73 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.35 -36.02 82.32 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.087 0.47 . . . . 64.55 111.163 170.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -76.74 -38.56 54.0 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.733 0.813 . . . . 74.41 111.024 175.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-85 -80.18 -0.86 37.92 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.871 0.868 . . . . 73.23 113.033 -173.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 p -58.2 -29.28 65.55 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.054 0.454 . . . . 73.42 110.608 169.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -82.29 110.35 17.38 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 115.086 -0.961 . . . . 71.25 108.76 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -69.85 -31.73 69.73 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.775 0.83 . . . . 75.54 111.122 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.0 p -67.73 -37.85 82.74 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.151 0.98 . . . . 62.23 111.18 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -61.76 -38.48 88.17 Favored 'General case' 0 C--O 1.25 1.114 0 C-N-CA 123.456 0.702 . . . . 75.25 111.05 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 22.6 mt -59.84 -49.7 82.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 CA-C-N 115.529 -0.759 . . . . 75.11 109.724 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.8 t -62.15 -35.06 77.63 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.222 0.609 . . . . 64.43 111.562 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -64.33 -47.72 78.31 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 124.055 0.847 . . . . 72.42 111.268 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.77 -32.44 59.94 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 110.002 -0.369 . . . . 74.25 110.002 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 9.7 tp -61.96 -50.62 71.39 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 124.184 0.994 . . . . 73.04 110.033 -174.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -61.23 -29.01 69.57 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 115.932 -0.576 . . . . 75.14 112.25 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.2 -54.48 6.44 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.355 0.662 . . . . 64.21 111.356 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 CA--C 1.546 0.789 0 C-N-CA 123.61 0.764 . . . . 74.44 109.622 -178.452 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.483 HG13 ' HB2' ' A' ' 141' ' ' ALA . 3.0 mp . . . . . 0 CA--C 1.552 1.024 0 N-CA-C 107.551 -1.277 . . . . 75.12 107.551 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.8 -31.4 62.61 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.855 0.862 . . . . 61.52 112.049 -173.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.409 ' CZ ' HD23 ' A' ' 31' ' ' LEU . 91.2 m-85 -125.57 25.54 6.97 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.107 -0.949 . . . . 72.52 110.694 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.28 -64.02 0.35 Allowed 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 125.488 1.515 . . . . 73.12 113.607 -163.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -67.31 -48.87 66.32 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.129 0.972 . . . . 73.52 111.553 -170.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.06 -43.38 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 114.765 -1.107 . . . . 75.51 110.875 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.491 ' HA ' ' HB2' ' A' ' 105' ' ' LEU . 67.3 t30 -78.34 -18.32 55.32 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.986 1.315 . . . . 73.35 110.212 -176.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.05 -39.78 72.07 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.746 -1.205 . . . . 73.14 107.746 168.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.73 -39.69 94.07 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.516 0.51 . . . . 72.41 110.523 170.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.491 ' HB2' ' HA ' ' A' ' 102' ' ' ASN . 9.4 mp -60.07 -43.92 95.11 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 109.766 -0.457 . . . . 73.33 109.766 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.541 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.4 t -66.04 -47.5 74.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.116 0.566 . . . . 70.13 110.789 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.35 -57.35 7.65 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.642 1.177 . . . . 75.54 110.966 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.8 t -63.52 -39.85 86.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-N 115.566 -0.743 . . . . 72.04 111.258 -177.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.2 t-105 -69.37 -39.05 78.29 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-O 118.543 -0.741 . . . . 74.41 111.88 -178.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -38.47 83.63 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 119.4 1.0 . . . . 74.4 110.534 175.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -60.5 -46.58 89.58 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.03 0.532 . . . . 73.25 110.903 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 8.4 tt -70.39 -48.2 57.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.595 1.158 . . . . 73.41 109.936 -172.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.1 p -65.63 -43.1 90.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.724 0.81 . . . . 74.5 110.891 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.472 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.7 mt -68.87 -35.33 76.77 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.234 -0.413 . . . . 72.42 112.041 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.67 -21.78 59.23 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-N 118.705 0.684 . . . . 75.43 110.896 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.0 mt -70.93 -35.33 72.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.916 -0.401 . . . . 75.1 109.916 167.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -29.81 65.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.73 0.812 . . . . 72.53 111.662 176.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 t -85.2 -62.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 122.728 0.411 . . . . 74.03 110.957 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -75.93 -56.14 4.95 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.203 0.601 . . . . 73.15 111.687 -170.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -85.12 -18.24 34.83 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.177 0.591 . . . . 74.12 110.808 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 61.52 16.22 7.41 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.63 1.572 . . . . 74.55 112.798 -177.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 36.6 mtm -71.84 140.83 83.94 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.522 -0.547 . . . . 73.32 109.522 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 C--N 1.371 1.747 0 C-N-CA 123.499 2.799 . . . . 74.43 112.813 -176.748 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.9 m0 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 113.077 0.769 . . . . 74.3 113.077 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.44 -37.11 82.48 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 122.785 0.434 . . . . 73.02 111.877 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -74.58 -43.58 54.95 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.904 0.482 . . . . 74.14 111.269 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.07 -53.71 49.46 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.502 0.721 . . . . 63.55 110.976 -174.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.83 -29.73 68.46 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.541 0.737 . . . . 74.21 112.461 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -71.52 -45.25 62.9 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 123.757 0.661 . . . . 74.03 110.729 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -68.27 -35.75 78.37 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.026 -0.533 . . . . 73.31 110.548 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.47 -45.0 81.17 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.39 -0.823 . . . . 74.31 109.043 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.483 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -57.69 -40.89 80.47 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 124.272 0.982 . . . . 62.33 111.181 178.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.77 -60.6 3.27 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 124.084 0.865 . . . . 72.43 110.903 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.76 -46.73 86.8 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.261 1.024 . . . . 74.24 111.689 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -78.58 -27.22 45.64 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.185 -1.371 . . . . 74.53 110.84 -170.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -61.68 -47.8 83.68 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 115.939 -0.573 . . . . 73.4 109.681 167.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -62.84 -37.3 86.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.766 0.666 . . . . 62.43 110.688 176.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.45 -20.91 62.86 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.779 0.675 . . . . 75.1 111.684 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.571 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -84.85 -62.45 1.54 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.804 0.275 . . . . 73.5 110.552 172.225 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -68.26 -24.3 64.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.432 1.093 . . . . 64.43 111.485 -166.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 44.0 ttm -139.57 83.22 1.92 Allowed 'General case' 0 C--O 1.24 0.554 0 N-CA-C 107.378 -1.342 . . . . 65.31 107.378 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.545 0.755 0 CA-C-N 115.614 -0.721 . . . . 75.42 109.303 -172.773 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 111.559 0.207 . . . . 63.11 111.559 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.19 -57.35 11.49 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.604 1.162 . . . . 64.44 108.776 171.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.94 -44.25 97.15 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 114.961 -1.018 . . . . 72.51 110.5 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -58.31 -51.19 70.84 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.571 0.545 . . . . 73.43 111.07 -175.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.517 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 22.0 m-70 -67.9 -52.1 40.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.032 0.533 . . . . 75.12 111.182 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.8 mt -53.61 -50.21 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 124.12 0.968 . . . . 75.12 111.86 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.441 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 99.6 mt -63.68 -46.44 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.545 -0.74 . . . . 74.32 109.667 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -51.63 -44.17 62.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 123.754 0.659 . . . . 65.42 110.571 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 84.6 mt -59.85 -50.9 71.99 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.729 0.643 . . . . 74.3 110.307 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.78 -33.82 87.0 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 124.385 1.053 . . . . 73.33 113.629 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 19.3 mm-40 -64.9 -52.79 54.59 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.668 -0.864 . . . . 71.54 108.668 176.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.71 -34.63 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.354 1.062 . . . . 75.43 110.946 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.71 -51.6 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 123.983 0.913 . . . . 74.24 109.736 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -64.06 -36.4 83.88 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.815 0.697 . . . . 73.54 110.346 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.1 mmmt -79.65 -29.05 40.84 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.352 0.661 . . . . 65.34 112.653 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.402 ' O ' ' HG2' ' A' ' 20' ' ' GLU . 11.6 ptm180 -87.98 -20.97 25.14 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.219 -0.301 . . . . 74.44 110.756 174.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.475 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 36.5 t -74.05 -20.26 60.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.781 0.832 . . . . 75.1 110.927 175.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -48.85 -36.43 16.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.832 0.853 . . . . 75.4 112.402 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.457 ' HB2' ' NH2' ' A' ' 82' ' ' ARG . 12.8 pt-20 -76.83 -3.37 38.1 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.464 0.913 . . . . 75.13 113.464 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 18.6 mmt -74.98 83.91 2.25 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.64 -0.504 . . . . 65.15 109.64 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -70.1 -36.45 74.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.929 -0.767 . . . . 73.33 108.929 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -95.86 158.26 15.53 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.743 -1.117 . . . . 73.34 109.215 168.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.691 ' SG ' HG23 ' A' ' 85' ' ' ILE . 91.8 m 56.51 58.96 3.84 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 124.237 0.961 . . . . 74.44 109.934 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -70.53 -49.4 48.56 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 113.675 -1.602 . . . . 72.22 110.379 -171.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 52.4 mttm -70.58 -38.93 74.14 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.027 -0.988 . . . . 74.23 110.995 -174.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.27 -26.34 61.95 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.29 0.636 . . . . 74.11 111.337 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.475 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 49.7 t -69.46 -37.48 77.33 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.42 0.688 . . . . 74.54 110.311 170.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.89 -34.23 68.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.548 -0.751 . . . . 74.52 110.573 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' NH1' ' HB3' ' A' ' 136' ' ' GLU . 29.0 mmt180 -69.2 -60.58 2.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.913 0.485 . . . . 73.2 109.985 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.7 tp -54.79 -49.35 71.16 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.857 0.723 . . . . 75.1 110.146 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.11 -55.48 30.09 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 124.059 0.849 . . . . 74.3 113.548 -176.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -67.94 -36.83 80.81 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.882 0.873 . . . . 74.43 110.996 -175.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 42.3 mtt-85 -63.42 -62.41 1.7 Allowed 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.822 0.701 . . . . 74.3 110.704 176.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 87.1 t -54.06 -46.76 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.041 0.936 . . . . 74.23 110.989 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.92 -38.43 90.96 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.228 -0.896 . . . . 70.11 109.708 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -75.71 -13.24 83.21 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 115.539 -0.755 . . . . 71.45 113.738 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 65.6 mt -84.09 -44.93 13.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.137 0.575 . . . . 75.24 110.003 174.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 pt -85.97 -24.43 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-N 115.498 -0.774 . . . . 71.4 112.407 -172.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -62.05 -47.28 91.1 Favored Pre-proline 0 N--CA 1.497 1.899 0 N-CA-C 112.899 0.703 . . . . 74.21 112.899 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.65 -51.48 11.02 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 121.758 1.639 . . . . 75.33 110.447 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.07 -19.61 64.89 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.296 -0.866 . . . . 72.32 111.772 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -68.1 -55.34 12.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.351 0.66 . . . . 63.2 110.013 174.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 50.7 mtm -64.65 -35.31 80.62 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.908 -1.042 . . . . 73.32 110.166 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.557 HD13 ' SD ' ' A' ' 122' ' ' MET . 68.3 mt -82.02 -18.92 41.63 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.76 1.224 . . . . 74.32 111.838 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -75.43 -43.1 51.53 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.454 -0.572 . . . . 72.32 109.454 172.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 . . . . . 0 N--CA 1.478 0.96 0 CA-C-N 114.788 -1.096 . . . . 75.12 110.231 177.066 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 110.495 -0.187 . . . . 73.24 110.495 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.14 -34.48 68.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.193 0.597 . . . . 71.33 110.136 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -59.35 -51.49 69.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.819 0.848 . . . . 73.4 110.27 170.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 115' ' ' LEU . 0.7 OUTLIER -54.96 -46.36 75.02 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.427 -1.26 . . . . 64.52 110.26 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 94.2 m -58.68 -46.83 86.37 Favored 'General case' 0 C--N 1.356 0.863 0 C-N-CA 124.025 0.93 . . . . 74.53 110.537 -178.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.1 m -61.88 -50.26 72.95 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.982 0.801 . . . . 74.44 110.352 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.441 ' HA ' ' HD3' ' A' ' 64' ' ' ARG . . . -59.78 -40.47 88.35 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.949 0.899 . . . . 72.3 111.407 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.436 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.4 mmt -66.58 -35.59 80.59 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.481 -0.781 . . . . 75.11 110.842 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -71.7 -35.66 70.31 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.278 0.631 . . . . 74.53 111.039 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.441 ' HD3' ' HA ' ' A' ' 61' ' ' ALA . 66.8 mtp85 -68.38 -41.13 81.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.072 0.949 . . . . 73.41 110.086 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -71.93 -41.2 68.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.64 -1.163 . . . . 73.25 110.023 -177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 1.2 tmtp? -59.78 -48.35 82.02 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.092 1.357 . . . . 72.4 109.066 175.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -61.52 -40.66 95.44 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 124.538 1.149 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.548 ' HB2' HD11 ' A' ' 105' ' ' LEU . . . -64.37 -36.1 83.04 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.698 0.799 . . . . 64.32 110.747 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -73.06 -27.69 61.88 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.282 0.633 . . . . 71.24 111.57 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 13.1 mm-40 -64.72 -41.55 95.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.338 -0.616 . . . . 75.54 109.338 172.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 5.0 mm-40 -59.48 -49.01 79.46 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-N 115.119 -0.946 . . . . 73.3 110.333 177.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.52 -47.48 85.38 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.957 0.786 . . . . 74.21 111.572 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.88 -48.75 80.3 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 124.4 1.063 . . . . 73.11 111.174 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 78' ' ' LYS . . . -61.35 -38.74 96.21 Favored Glycine 0 C--N 1.351 1.378 0 O-C-N 124.026 0.829 . . . . 31.41 112.815 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -62.89 -56.78 14.25 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 118.765 -0.636 . . . . 73.21 111.135 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.567 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.8 OUTLIER -63.49 -23.06 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 122.756 0.423 . . . . 75.23 112.053 177.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.47 -38.05 80.71 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.675 0.39 . . . . 73.5 110.262 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 74' ' ' GLY . 31.5 mmtp -83.9 -29.5 27.13 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.453 0.301 . . . . 72.43 111.129 176.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.567 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.8 m-85 -77.46 -8.52 57.88 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.319 1.048 . . . . 72.14 111.335 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.1 p -56.37 -30.41 62.64 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.214 0.606 . . . . 74.24 109.889 171.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -81.21 102.13 10.14 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.54 -1.281 . . . . 71.33 107.54 165.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.538 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.6 mpt_? -70.32 -24.89 63.09 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.749 0.82 . . . . 71.12 110.535 -175.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 72.4 p -66.89 -40.98 87.93 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.947 0.899 . . . . 54.5 110.478 172.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -57.86 -42.29 84.2 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.011 0.924 . . . . 74.12 110.65 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.691 HG23 ' SG ' ' A' ' 24' ' ' CYS . 15.7 mt -58.81 -57.45 11.16 Favored 'Isoleucine or valine' 0 C--N 1.356 0.889 0 CA-C-N 115.323 -0.853 . . . . 75.24 109.379 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.4 t -53.77 -37.09 63.08 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.766 0.827 . . . . 71.0 112.146 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -60.67 -45.71 93.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.832 1.253 . . . . 75.1 111.277 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -25.95 29.65 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.408 0.147 . . . . 75.32 110.78 176.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.472 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 13.4 tp -78.01 -29.21 49.42 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.572 0.749 . . . . 75.21 111.635 -167.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -72.76 -26.62 61.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.114 0.566 . . . . 75.01 110.214 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.13 -37.27 20.42 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.018 0.927 . . . . 74.14 110.369 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.2 p . . . . . 0 CA--C 1.543 0.682 0 C-N-CA 123.108 0.563 . . . . 63.34 110.384 -178.415 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.405 HD12 ' HB2' ' A' ' 141' ' ' ALA . 16.3 mm . . . . . 0 CA--C 1.544 0.716 0 N-CA-C 107.923 -1.139 . . . . 71.3 107.923 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.3 mp -45.33 -38.52 5.84 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.198 0.999 . . . . 73.53 112.488 -177.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -125.65 39.31 3.99 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 123.924 0.89 . . . . 73.52 109.797 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -56.55 -58.47 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.755 0.707 . . . . 74.11 111.399 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.32 -47.89 53.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.523 1.129 . . . . 72.11 110.229 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.71 -63.53 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.605 0 O-C-N 124.372 1.045 . . . . 72.34 110.933 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -65.9 -28.03 68.64 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.774 1.23 . . . . 74.11 111.475 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -57.66 -46.87 83.68 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 110.02 -0.363 . . . . 74.41 110.02 169.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -67.36 -32.55 73.56 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.189 0.596 . . . . 75.41 111.944 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 68' ' ' ALA . 11.0 mp -60.7 -47.92 84.09 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 110.012 -0.366 . . . . 75.04 110.012 171.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.7 m -68.46 -39.67 81.34 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.048 0.939 . . . . 64.05 111.323 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 9.5 t0 -68.0 -58.41 4.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.468 -1.242 . . . . 65.44 109.151 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.5 t -65.15 -33.93 67.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.449 -0.796 . . . . 73.12 110.348 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 49.3 t-105 -60.62 -44.09 96.73 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 119.187 -0.435 . . . . 74.53 111.479 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 19.1 pttm -64.61 -43.85 92.46 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.987 -0.745 . . . . 74.41 108.987 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.7 mt-10 -61.05 -42.57 98.73 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.696 0.799 . . . . 72.12 110.747 178.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.436 HD11 ' SD ' ' A' ' 62' ' ' MET . 7.0 tt -71.41 -48.47 49.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.966 1.306 . . . . 74.42 109.785 -171.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 39.3 t -61.0 -34.66 75.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.418 1.087 . . . . 74.21 110.922 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -63.9 -58.47 6.68 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 123.043 0.537 . . . . 75.4 111.502 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.554 HD11 HD23 ' A' ' 58' ' ' LEU . 2.0 pp -67.31 -20.26 65.58 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 118.569 0.622 . . . . 70.21 112.164 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.626 HD13 ' SD ' ' A' ' 122' ' ' MET . 46.7 mt -64.01 -55.27 23.54 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.747 0.419 . . . . 72.55 110.635 167.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.22 -26.49 62.96 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.052 0.389 . . . . 74.3 112.052 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 79.3 t -78.42 -54.33 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.418 0.687 . . . . 75.43 110.517 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -90.15 -59.14 2.27 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.075 0.398 . . . . 73.23 112.075 -172.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -77.25 -14.44 59.76 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 122.721 0.408 . . . . 74.3 110.944 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.14 54.69 6.61 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.904 1.281 . . . . 64.44 108.858 -175.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.626 ' SD ' HD13 ' A' ' 116' ' ' LEU . 51.0 ttm -92.24 131.0 35.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 108.414 -0.958 . . . . 75.31 108.414 174.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 2.7 Cg_exo . . . . . 0 C--N 1.371 1.753 0 C-N-CA 122.958 2.438 . . . . 74.41 113.61 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 111.7 0.259 . . . . 73.33 111.7 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.11 -41.38 92.48 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.499 0.719 . . . . 72.33 111.216 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.433 ' HA ' HE21 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -72.03 -45.14 61.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.897 0.879 . . . . 71.5 111.464 -178.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.444 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 19.0 mm-40 -50.1 -55.95 12.85 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.656 1.182 . . . . 64.12 111.449 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 -52.18 45.84 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 114.467 -1.242 . . . . 73.31 111.979 -174.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.74 -40.08 91.06 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 118.247 0.476 . . . . 74.42 111.289 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -53.16 19.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.409 0.684 . . . . 74.25 109.237 -177.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.89 -34.87 78.73 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.911 -1.04 . . . . 70.22 110.234 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 96' ' ' ILE . . . -72.03 -31.93 66.64 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.103 0.961 . . . . 64.42 111.215 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -65.06 -47.26 77.97 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 123.738 0.649 . . . . 65.02 110.327 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.36 -33.8 75.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.768 -0.651 . . . . 74.32 111.593 174.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.7 t0 -72.58 -41.96 65.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.231 1.012 . . . . 71.24 111.521 -178.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.472 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 26.8 ttp85 -60.76 -43.23 98.27 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 114.855 -1.066 . . . . 75.11 109.128 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 13.7 ttp-105 -66.71 -33.92 76.7 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.972 -1.013 . . . . 74.41 111.548 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.4 -27.61 66.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.452 0.301 . . . . 73.4 111.101 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -47.64 10.57 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.198 0.599 . . . . 75.32 110.653 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -80.99 -41.63 22.44 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.67 0.788 . . . . 74.55 112.43 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 49.1 ttm -76.73 -61.0 2.11 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.515 -1.291 . . . . 75.22 107.515 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 18.5 tp . . . . . 0 N--CA 1.487 1.398 0 C-N-CA 124.705 1.202 . . . . 75.24 112.207 175.272 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 108.2 -1.037 . . . . 75.01 108.2 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.538 ' HA ' ' HD2' ' A' ' 66' ' ' LYS . 5.1 p30 -55.76 -43.99 77.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.471 -1.24 . . . . 61.52 111.14 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.451 HD21 HD12 ' A' ' 7' ' ' ILE . 29.2 mt -65.55 -33.44 75.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.529 0.731 . . . . 72.41 111.789 175.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 tmtp? -60.7 -44.92 95.97 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 107.973 -1.121 . . . . 75.24 107.973 177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -68.72 -40.14 80.08 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.858 -0.61 . . . . 74.1 111.915 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.451 HD12 HD21 ' A' ' 4' ' ' LEU . 83.9 mt -58.9 -53.14 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.394 0.678 . . . . 74.14 110.612 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.73 HG21 ' HG2' ' A' ' 43' ' ' GLU . 30.6 mm -70.29 -53.68 22.0 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-N 115.413 -0.812 . . . . 72.43 110.806 -174.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 92.1 m -60.41 -58.96 6.27 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 123.834 0.709 . . . . 73.15 110.848 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.428 ' O ' HG13 ' A' ' 14' ' ' ILE . 95.0 mt -66.48 -32.41 73.76 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 118.644 -0.693 . . . . 75.03 111.748 -175.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.438 ' HA2' HD13 ' A' ' 14' ' ' ILE . . . -63.09 -43.01 99.39 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 121.387 -0.435 . . . . 71.02 112.473 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.02 -38.77 79.39 Favored 'General case' 0 CA--C 1.552 1.026 0 O-C-N 122.427 -0.455 . . . . 72.04 110.647 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 73.0 t -64.32 -34.85 71.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.554 0.742 . . . . 72.01 110.386 175.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.464 HG22 HG23 ' A' ' 35' ' ' VAL . 54.8 mt -56.85 -52.81 50.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.669 0.787 . . . . 72.23 109.152 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -58.96 -33.05 70.19 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 123.998 0.811 . . . . 74.12 111.522 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -67.48 -57.65 6.15 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.549 0.739 . . . . 71.13 112.023 176.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 15.0 ptp180 -82.53 -15.55 51.96 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 113.015 0.746 . . . . 75.13 113.015 -172.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.599 ' SG ' HD23 ' A' ' 31' ' ' LEU . 49.2 t -68.98 -28.37 66.55 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.097 0.408 . . . . 72.11 111.967 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -5.26 58.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.458 0.303 . . . . 74.12 111.71 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.86 -39.43 89.12 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 123.412 0.685 . . . . 74.12 109.608 172.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.628 ' SD ' ' HA ' ' A' ' 80' ' ' SER . 3.3 mpp? -64.7 104.29 0.8 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.389 -0.823 . . . . 75.51 109.658 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -31.78 71.15 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.526 0.73 . . . . 75.55 109.398 172.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.47 ' O ' ' HB3' ' A' ' 21' ' ' MET . 87.2 m-85 -91.89 169.68 10.48 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.577 -1.192 . . . . 74.51 109.017 170.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.632 ' SG ' HG23 ' A' ' 85' ' ' ILE . 56.7 m 56.41 56.24 5.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.255 1.026 . . . . 73.11 110.204 -172.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.87 -47.13 66.68 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.564 -1.653 . . . . 74.45 109.961 -174.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.653 ' HZ1' ' HA ' ' A' ' 140' ' ' ASP . 4.1 mtpm? -82.0 -17.72 45.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.889 -1.05 . . . . 74.52 109.824 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.671 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 10.7 mm-40 -70.62 -38.82 73.98 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 110.324 -0.25 . . . . 73.14 110.324 168.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.534 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 52.5 t -67.52 -32.92 74.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.843 0.715 . . . . 75.31 110.041 174.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -62.44 -62.98 1.38 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.772 0.429 . . . . 75.41 111.854 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -41.21 94.29 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.627 0.371 . . . . 75.44 111.875 -176.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.599 HD23 ' SG ' ' A' ' 18' ' ' CYS . 60.1 tp -65.24 -59.61 3.88 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.586 0.354 . . . . 71.23 110.074 179.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.48 -40.77 92.77 Favored Glycine 0 C--N 1.345 1.046 0 O-C-N 124.41 1.068 . . . . 70.51 113.459 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -65.69 -49.34 68.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.522 0.729 . . . . 62.32 111.102 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.532 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 55.3 mtt-85 -57.09 -58.41 8.31 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.859 0.725 . . . . 74.3 110.147 175.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.464 HG23 HG22 ' A' ' 14' ' ' ILE . 54.5 t -52.1 -45.99 42.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 124.048 0.939 . . . . 72.21 111.672 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.18 -45.75 93.32 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.438 0.461 . . . . 72.41 110.878 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.51 -24.45 69.4 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 123.164 0.29 . . . . 63.02 113.647 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.604 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 30.2 mt -85.86 -51.6 6.29 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 123.488 0.715 . . . . 73.54 111.401 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.427 HG22 ' HA3' ' A' ' 11' ' ' GLY . 17.0 pt -72.66 -40.81 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.422 -0.799 . . . . 75.3 111.214 -173.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.44 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 23.8 tptm -51.33 -50.54 75.53 Favored Pre-proline 0 N--CA 1.49 1.571 0 N-CA-C 113.778 1.029 . . . . 72.52 113.778 -170.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 51.0 Cg_exo -57.48 -41.57 70.49 Favored 'Trans proline' 0 C--N 1.387 2.595 0 C-N-CA 121.726 1.617 . . . . 64.0 112.569 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.98 -25.51 59.97 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.185 -0.916 . . . . 74.24 111.218 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.73 ' HG2' HG21 ' A' ' 8' ' ' ILE . 38.5 mt-10 -67.69 -44.03 78.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.034 0.934 . . . . 73.32 109.562 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.3 mmt -59.69 -47.35 85.97 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 124.701 1.25 . . . . 74.43 110.165 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.2 -30.92 63.85 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.716 0.806 . . . . 74.21 112.071 -177.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.53 -29.86 61.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.94 0.896 . . . . 74.25 109.679 177.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 123.623 0.769 . . . . 74.35 109.94 -179.94 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.13 -43.39 98.54 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.335 0.654 . . . . 74.11 110.485 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? -74.77 -21.97 59.03 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.831 -0.622 . . . . 73.33 112.147 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.8 HD12 HD13 ' A' ' 115' ' ' LEU . 13.0 tp -81.22 -30.69 34.17 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.29 0.636 . . . . 74.41 110.316 174.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.8 m -63.45 -45.35 91.29 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.435 -0.95 . . . . 74.25 108.435 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.466 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 57.2 m -60.58 -44.25 96.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 124.401 1.063 . . . . 72.24 111.244 174.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.51 -42.99 98.46 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.6 0.76 . . . . 61.12 111.275 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.45 -30.67 69.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.164 0.586 . . . . 62.04 111.042 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -74.15 -32.92 63.33 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.133 0.573 . . . . 70.14 111.164 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.8 mtt180 -65.21 -47.1 78.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 109.143 -0.688 . . . . 75.25 109.143 175.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.604 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 4.5 t80 -65.51 -45.49 83.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.673 -1.603 . . . . 75.41 109.772 -175.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 34.4 tttm -49.67 -57.71 6.7 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 113.915 -1.493 . . . . 75.31 110.269 169.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -62.91 -31.47 72.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.704 0.802 . . . . 73.05 111.824 -176.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.496 ' HB2' HD12 ' A' ' 105' ' ' LEU . . . -70.0 -37.75 75.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.911 0.884 . . . . 73.21 111.164 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.03 -21.14 40.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.152 0.581 . . . . 75.52 110.541 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 78.1 mt-10 -72.55 -38.13 68.07 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.352 0.661 . . . . 63.05 110.05 171.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 48.3 mt-10 -64.67 -50.21 67.94 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.696 -0.684 . . . . 74.21 109.381 174.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -57.07 -48.18 79.2 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.279 0.987 . . . . 72.13 111.71 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -56.54 -42.73 78.98 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.436 1.085 . . . . 73.41 110.704 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.24 -36.49 89.84 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.646 0.592 . . . . 64.21 113.218 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.2 mm-40 -63.08 -55.51 24.83 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.941 -0.392 . . . . 71.34 109.941 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.628 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.3 pt -69.03 -20.18 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.366 0.666 . . . . 75.14 112.404 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -62.06 -46.66 88.15 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 122.973 0.509 . . . . 72.33 109.92 167.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -82.84 -24.33 33.35 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.349 0.5 . . . . 75.23 112.349 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.628 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.0 m-85 -81.18 -12.3 59.22 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.543 0.737 . . . . 75.32 111.239 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.628 ' HA ' ' SD ' ' A' ' 21' ' ' MET . 96.9 p -55.78 -28.71 57.49 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.669 0.606 . . . . 60.11 110.568 176.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.74 104.82 13.26 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.406 -1.331 . . . . 72.21 107.406 162.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -69.67 -23.73 63.5 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.728 0.811 . . . . 74.32 110.3 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -63.34 -35.87 81.81 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.16 -0.927 . . . . 74.5 111.884 174.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -58.55 -46.37 87.0 Favored 'General case' 0 C--O 1.256 1.44 0 C-N-CA 124.262 1.025 . . . . 75.53 109.795 175.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.632 HG23 ' SG ' ' A' ' 24' ' ' CYS . 30.7 mt -56.12 -57.43 8.56 Favored 'Isoleucine or valine' 0 C--N 1.356 0.877 0 CA-C-N 115.229 -0.896 . . . . 73.11 109.766 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.2 t -56.53 -34.9 67.48 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.358 1.036 . . . . 62.12 111.504 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -66.06 -45.37 81.57 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.529 0.732 . . . . 75.14 111.702 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.39 -22.81 32.64 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 121.122 -0.231 . . . . 74.41 110.418 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 tp -79.19 -29.44 42.9 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.934 0.894 . . . . 73.53 111.259 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -72.1 -17.2 62.0 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.84 -0.618 . . . . 75.34 110.873 176.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -121.49 16.43 11.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.66 1.184 . . . . 63.12 111.002 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 C--N 1.354 0.791 0 N-CA-C 109.55 -0.537 . . . . 72.31 109.55 179.735 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 C--O 1.241 0.61 0 N-CA-C 109.561 -0.533 . . . . 72.05 109.561 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.671 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 5.8 tp -68.14 -41.99 80.78 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.034 0.933 . . . . 74.54 110.849 -175.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 97' ' ' LEU . 69.8 m-85 -106.49 36.86 2.47 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 114.046 -1.434 . . . . 75.25 109.889 -175.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.61 -58.52 5.63 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.78 0.832 . . . . 74.52 112.781 -175.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.7 -49.84 69.29 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.393 -0.821 . . . . 74.42 111.219 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.79 -43.69 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 123.4 0.68 . . . . 75.24 111.006 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.47 HD22 ' NH1' ' A' ' 34' ' ' ARG . 33.0 t30 -71.16 -28.05 63.98 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.193 0.997 . . . . 72.34 110.516 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.39 -35.03 79.72 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.845 -0.798 . . . . 74.13 108.845 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -64.55 -53.48 47.17 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 109.796 -0.446 . . . . 73.32 109.796 168.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.496 HD12 ' HB2' ' A' ' 68' ' ' ALA . 10.7 mp -52.07 -38.45 57.19 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.034 0.534 . . . . 74.45 111.348 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.0 t -74.48 -56.62 4.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.326 0.65 . . . . 71.22 110.471 -175.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -53.9 -55.21 28.98 Favored 'General case' 0 C--O 1.257 1.466 0 C-N-CA 124.547 1.139 . . . . 71.44 110.715 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.2 t -65.62 -50.26 72.69 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 CA-C-N 113.547 -1.661 . . . . 70.21 110.84 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.54 -37.39 85.93 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 118.687 0.676 . . . . 73.52 111.478 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -56.69 -60.3 3.76 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.541 0.525 . . . . 72.43 109.764 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.45 -42.29 70.43 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 124.028 0.83 . . . . 73.32 111.315 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.01 -58.48 4.85 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.192 1.397 . . . . 74.35 110.156 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.2 p -59.09 -41.16 87.41 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.594 0.757 . . . . 73.13 111.602 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.19 -46.29 84.57 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.094 0.557 . . . . 72.14 112.286 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.8 HD13 HD12 ' A' ' 58' ' ' LEU . 4.2 pp -72.4 -22.94 61.05 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 122.271 -0.268 . . . . 64.15 110.706 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.551 HD11 ' SD ' ' A' ' 122' ' ' MET . 88.1 mt -72.79 -36.01 67.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.402 0.681 . . . . 71.43 110.616 171.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -38.72 86.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 75.45 109.756 171.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 97.2 t -68.99 -60.49 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.085 0 C-N-CA 123.53 0.732 . . . . 61.34 111.558 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.16 -60.93 2.16 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.622 0.769 . . . . 70.34 111.358 -172.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -93.63 -2.63 53.81 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 114.935 -1.03 . . . . 62.53 111.2 -166.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.34 15.78 7.96 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.307 1.043 . . . . 73.21 110.72 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.551 ' SD ' HD11 ' A' ' 116' ' ' LEU . 40.2 ttm -66.61 116.84 38.59 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 123.814 0.846 . . . . 63.21 110.334 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 C--N 1.373 1.855 0 C-N-CA 123.315 2.677 . . . . 65.52 113.231 -168.27 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 12.2 m0 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 113.006 0.743 . . . . 73.44 113.006 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.0 -48.95 41.04 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-O 120.821 0.343 . . . . 74.2 110.828 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -70.05 -35.85 74.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.471 -0.786 . . . . 75.2 112.019 -178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -60.67 -49.14 78.7 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.409 0.683 . . . . 74.55 111.191 -177.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -73.93 -39.78 63.57 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.731 -0.668 . . . . 72.33 112.011 -175.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -58.28 -59.0 6.0 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.618 -0.512 . . . . 75.3 109.618 176.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -52.7 -61.75 2.09 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 124.603 1.189 . . . . 54.14 111.095 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.653 ' HA ' ' HZ1' ' A' ' 26' ' ' LYS . 1.1 m-20 -64.98 -50.74 65.16 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.077 -0.965 . . . . 74.45 111.489 -168.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.4 ' HA ' ' NE2' ' A' ' 27' ' ' GLN . . . -73.17 -28.9 62.48 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.813 0.696 . . . . 62.51 112.507 -172.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.18 -47.09 68.88 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.784 -0.45 . . . . 71.43 109.784 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.43 -37.06 85.83 Favored 'General case' 0 N--CA 1.484 1.25 0 O-C-N 123.915 0.759 . . . . 75.42 111.828 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.579 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 25.4 t0 -78.36 -42.92 29.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.94 0.896 . . . . 72.11 110.923 -171.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -63.6 -40.62 97.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 108.338 -0.986 . . . . 73.04 108.338 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -60.0 -46.89 88.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.043 0.937 . . . . 74.41 110.859 175.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.38 -23.22 60.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.343 0.657 . . . . 74.21 111.632 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -73.04 -57.13 4.25 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.171 0.588 . . . . 65.33 109.462 178.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -74.33 -47.29 35.48 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.341 -0.845 . . . . 74.03 110.599 -173.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 38.5 ttm -89.35 73.46 7.96 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 107.151 -1.425 . . . . 74.42 107.151 168.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 17.5 tp . . . . . 0 CA--C 1.545 0.754 0 CA-C-N 115.069 -0.969 . . . . 72.34 109.8 -177.773 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 112.167 0.432 . . . . 72.12 112.167 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -48.58 -45.17 37.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.027 1.331 . . . . 75.13 109.997 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.9 mt -57.37 -43.25 83.41 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.747 -1.115 . . . . 73.24 111.949 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -59.13 -46.68 87.73 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.565 0.541 . . . . 72.54 110.16 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -62.6 -43.55 98.53 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.927 -0.578 . . . . 64.21 111.618 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.78 -48.77 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 124.3 1.04 . . . . 73.41 110.96 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.7 mt -62.68 -42.25 95.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 CA-C-N 114.602 -1.181 . . . . 75.44 111.151 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.412 ' O ' HG22 ' A' ' 13' ' ' VAL . 96.5 m -61.02 -50.56 72.87 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.368 0.667 . . . . 73.3 110.252 178.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.2 -42.23 94.64 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.6 0.76 . . . . 73.41 111.019 -177.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.12 99.7 Favored Glycine 0 C--N 1.349 1.254 0 O-C-N 123.618 0.574 . . . . 61.23 112.887 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.35 -43.03 92.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 122.268 0.227 . . . . 71.34 111.242 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 9' ' ' THR . 86.2 t -61.71 -35.32 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.637 0.775 . . . . 75.21 110.526 177.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -59.88 -61.02 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.326 1.05 . . . . 75.25 110.439 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.9 -33.12 73.65 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 123.644 0.59 . . . . 74.41 111.187 -175.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -62.21 -60.73 3.16 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.267 1.027 . . . . 73.32 110.825 177.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -78.57 -17.18 56.51 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.134 0.573 . . . . 73.44 112.514 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.5 t -60.95 -16.75 46.25 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.22 1.008 . . . . 61.52 111.49 175.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -58.39 -16.27 14.05 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.61 0.764 . . . . 71.54 112.685 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -62.3 -30.73 71.35 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.613 0.765 . . . . 74.25 111.818 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.5 mmt -67.85 90.38 0.29 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 120.909 0.385 . . . . 73.22 110.264 -175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.75 -49.43 53.13 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 107.806 -1.183 . . . . 74.31 107.806 173.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -93.63 -179.51 5.04 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.53 -1.668 . . . . 73.13 109.721 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.598 ' SG ' HG22 ' A' ' 85' ' ' ILE . 34.1 m 53.01 56.24 7.83 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-O 122.199 1.0 . . . . 74.22 110.008 -167.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.87 -49.83 41.83 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 113.109 -1.86 . . . . 73.15 110.624 -169.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.1 -39.77 63.16 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.807 -1.088 . . . . 73.53 108.975 -174.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -65.12 -27.01 68.44 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.31 0.644 . . . . 63.35 112.031 173.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.3 t -77.24 -35.33 55.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 122.605 0.362 . . . . 75.05 110.656 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -70.07 -33.4 71.86 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 116.412 -0.358 . . . . 71.3 110.416 172.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.465 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -67.94 -58.18 4.97 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.62 0.768 . . . . 74.44 109.822 179.699 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.97 -44.91 83.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.417 1.087 . . . . 73.4 110.359 178.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.58 -49.61 72.19 Favored Glycine 0 C--N 1.346 1.139 0 O-C-N 124.064 0.852 . . . . 74.42 112.87 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -65.9 -38.01 87.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.874 0.47 . . . . 73.15 111.399 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -60.0 -53.59 56.08 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.059 0.543 . . . . 73.51 110.672 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 39' ' ' ILE . 61.9 t -59.5 -50.49 79.72 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.425 0 O-C-N 124.25 0.968 . . . . 65.3 110.846 -177.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.52 -46.49 85.79 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.6 0.563 . . . . 74.33 111.426 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.52 -19.15 74.36 Favored Glycine 0 N--CA 1.468 0.828 0 O-C-N 123.303 0.377 . . . . 74.43 113.367 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -86.64 -48.16 8.55 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.658 0.783 . . . . 73.11 111.663 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 35' ' ' VAL . 14.0 pt -79.54 -34.73 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 119.366 -0.35 . . . . 72.31 111.373 -173.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.33 -51.84 78.67 Favored Pre-proline 0 N--CA 1.488 1.449 0 N-CA-C 113.843 1.053 . . . . 73.53 113.843 -174.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.32 -31.78 93.28 Favored 'Trans proline' 0 C--N 1.386 2.542 0 C-N-CA 121.573 1.515 . . . . 53.23 112.042 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.69 -40.99 72.58 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.169 0.588 . . . . 73.33 110.52 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.64 -37.36 83.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.568 0.747 . . . . 74.44 111.016 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.0 -55.05 40.21 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.909 0.756 . . . . 74.32 111.173 -178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 pp -77.42 -33.68 54.88 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.519 -0.764 . . . . 55.52 112.355 -175.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.81 -43.54 62.58 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.311 0.644 . . . . 74.12 110.066 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 122.994 0.518 . . . . 75.44 110.377 175.894 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.6 p . . . . . 0 C--O 1.244 0.778 0 N-CA-C 109.302 -0.629 . . . . 73.45 109.302 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -58.95 -58.67 7.64 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.195 0.598 . . . . 72.43 111.044 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.9 -18.61 60.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.345 0.498 . . . . 72.22 112.345 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.9 -56.19 13.08 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 108.085 -1.079 . . . . 73.53 108.085 175.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 m -62.21 -39.73 93.74 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.071 -0.968 . . . . 72.3 110.824 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 88.5 m -61.44 -44.81 96.47 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.542 0.737 . . . . 74.11 111.36 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.85 86.08 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.142 0.577 . . . . 63.14 110.772 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.83 -27.82 68.53 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.746 0.654 . . . . 62.45 111.037 176.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -75.0 -41.27 59.8 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.144 0.577 . . . . 63.32 110.463 176.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 60' ' ' THR . 87.8 mtt180 -62.2 -40.55 96.44 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.31 0.576 . . . . 74.02 110.161 174.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.404 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.6 OUTLIER -65.88 -56.75 10.21 Favored 'General case' 0 C--O 1.216 -0.666 0 CA-C-N 114.422 -1.263 . . . . 75.33 109.277 -177.45 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.401 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.0 tmtt? -55.04 -41.28 71.21 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.876 1.27 . . . . 75.2 110.713 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.08 97.78 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.357 0.663 . . . . 63.14 111.296 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.469 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -67.4 -39.48 85.57 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.614 0.766 . . . . 75.23 111.156 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.404 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.4 mm? -67.02 -32.31 73.45 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.539 0.736 . . . . 74.31 111.002 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.8 mt-10 -68.08 -40.64 82.64 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.138 0.575 . . . . 74.1 111.288 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.9 mt-10 -67.92 -38.75 83.3 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.167 0.587 . . . . 72.22 110.11 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.45 ' HA ' ' HE2' ' A' ' 98' ' ' PHE . . . -64.71 -45.85 84.82 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.113 0.565 . . . . 71.35 110.603 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -59.51 -38.97 82.33 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 124.675 1.19 . . . . 74.1 110.561 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.3 -40.36 80.89 Favored Glycine 0 C--N 1.344 0.996 0 CA-C-N 114.894 -1.048 . . . . 75.52 112.472 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 24.0 mm-40 -68.07 -45.23 74.41 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.976 -0.535 . . . . 74.34 111.208 -178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.497 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.7 OUTLIER -68.02 -26.39 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 CA-C-N 118.525 0.602 . . . . 73.02 111.544 175.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.76 -35.06 79.87 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.031 0.443 . . . . 65.43 110.315 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -76.43 -38.39 55.58 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.264 0.626 . . . . 74.13 110.847 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -75.01 -7.41 53.57 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.906 0.882 . . . . 65.43 112.596 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.4 p -57.72 -33.09 68.05 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.18 0.514 . . . . 71.22 110.308 176.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.05 109.81 5.35 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 107.721 -1.214 . . . . 73.33 107.721 164.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -67.57 -30.21 69.77 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 123.563 0.745 . . . . 74.44 111.022 -170.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -72.99 -27.17 61.64 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.153 -0.93 . . . . 75.13 111.67 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -60.85 -40.98 94.96 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 123.794 0.838 . . . . 72.03 110.866 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.598 HG22 ' SG ' ' A' ' 24' ' ' CYS . 16.0 mt -61.06 -55.3 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.165 -0.925 . . . . 74.12 109.252 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.1 -31.07 68.59 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.455 0.702 . . . . 72.55 111.607 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -63.17 -47.62 81.87 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.335 1.054 . . . . 64.04 111.321 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -29.84 43.1 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 120.243 -0.583 . . . . 72.02 110.285 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 92' ' ' SER . 6.8 tp -74.49 -27.0 60.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.682 0.793 . . . . 64.23 111.512 -169.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -71.88 -22.1 61.56 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.947 0.499 . . . . 72.42 110.842 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.44 -35.72 13.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.901 0.88 . . . . 72.44 110.145 174.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.425 ' HB3' ' HA ' ' A' ' 89' ' ' LEU . 32.1 t . . . . . 0 N--CA 1.474 0.748 0 C-N-CA 124.116 0.967 . . . . 72.44 110.974 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 12.4 mm . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 119.274 -0.393 . . . . 73.34 110.103 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.432 HD13 ' SG ' ' A' ' 24' ' ' CYS . 5.4 tp -49.47 -40.58 37.6 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.389 0.676 . . . . 74.51 111.529 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.531 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 36.1 m-85 -124.38 42.42 3.26 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.681 -1.145 . . . . 74.34 109.993 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -49.87 -66.1 0.45 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.556 0.743 . . . . 75.35 110.461 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.18 -46.78 72.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.088 0.868 . . . . 65.12 111.293 -175.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.8 t -67.58 -55.97 15.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.582 -0.736 . . . . 73.43 111.315 -172.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.531 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 13.8 t30 -63.38 -28.41 69.97 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.999 0.92 . . . . 74.1 111.012 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -61.57 -42.85 99.45 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 110.146 -0.316 . . . . 72.22 110.146 170.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -59.45 -48.44 81.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 123.351 0.407 . . . . 74.11 110.764 173.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.469 HD11 ' HB1' ' A' ' 68' ' ' ALA . 10.0 mp -55.52 -41.63 73.39 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.537 0.335 . . . . 74.1 110.465 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.1 t -64.83 -52.92 54.13 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.151 0.98 . . . . 73.23 111.012 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.513 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.7 m-20 -65.76 -46.55 78.4 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.672 0.789 . . . . 75.23 111.787 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 85.2 t -66.99 -35.9 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 122.714 0.406 . . . . 74.51 110.545 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 21.4 t-105 -62.74 -41.57 99.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.706 0.402 . . . . 71.53 110.8 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtpt -56.33 -56.16 24.5 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 123.465 0.478 . . . . 75.25 109.746 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.55 -38.97 72.62 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.217 1.007 . . . . 62.41 111.331 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.0 OUTLIER -66.14 -59.62 3.59 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.237 0.961 . . . . 73.02 109.072 -173.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -59.06 -33.2 70.5 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.07 0.948 . . . . 72.34 111.195 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.443 ' O ' HG21 ' A' ' 118' ' ' VAL . 70.8 mt -60.55 -63.85 1.16 Allowed 'General case' 0 C--N 1.358 0.946 0 O-C-N 123.752 0.657 . . . . 64.34 111.193 173.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.02 -29.86 71.15 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.34 0.496 . . . . 75.31 112.34 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 88.4 mt -66.78 -45.42 78.5 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.854 0.862 . . . . 74.44 110.603 175.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -76.97 -20.29 56.27 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.079 0.152 . . . . 62.42 111.365 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 114' ' ' LEU . 54.7 t -71.72 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 123.342 0.657 . . . . 71.54 110.749 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -89.96 -58.48 2.49 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.324 0.583 . . . . 74.42 111.781 -175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -77.8 -12.86 60.01 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.137 -0.938 . . . . 75.15 110.855 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.451 ' O ' ' HD3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER 64.17 18.13 11.08 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.341 1.457 . . . . 72.53 110.787 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 87.9 mtp -64.12 112.66 8.02 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.498 0.719 . . . . 74.21 110.038 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 C--N 1.375 1.929 0 C-N-CA 123.821 3.014 . . . . 72.12 110.753 -176.52 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 113.091 0.775 . . . . 72.3 113.091 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.78 -36.03 79.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.009 0.523 . . . . 73.4 111.577 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -74.75 -36.27 62.59 Favored 'General case' 0 C--O 1.257 1.452 0 C-N-CA 123.301 0.64 . . . . 64.42 110.313 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 37.7 mt-10 -58.16 -62.5 1.78 Allowed 'General case' 0 C--N 1.355 0.818 0 CA-C-N 114.338 -1.301 . . . . 75.41 109.184 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -52.57 -37.06 57.16 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.041 0.838 . . . . 74.12 112.748 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -63.4 -60.63 3.12 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.267 0.354 . . . . 74.24 110.571 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -36.33 83.75 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.456 1.122 . . . . 73.43 110.0 -176.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.67 -63.63 1.02 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 113.493 -1.685 . . . . 73.02 110.32 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.23 68.08 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 124.372 1.045 . . . . 60.32 111.564 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 17.4 t70 -60.42 -63.5 1.28 Allowed 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.526 -0.546 . . . . 72.23 109.526 175.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.8 -32.0 73.48 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 123.694 0.621 . . . . 63.41 112.116 -177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -71.65 -35.79 70.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.083 0.553 . . . . 74.03 110.644 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -67.0 -39.78 87.19 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.929 0.892 . . . . 75.35 109.216 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 12.2 mmt180 -61.34 -48.77 79.81 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.508 0.505 . . . . 75.41 110.0 177.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.32 69.82 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.436 0.695 . . . . 63.31 111.993 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.86 -58.89 3.07 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.569 0.543 . . . . 74.22 110.275 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -75.2 -53.13 9.34 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.324 0.65 . . . . 63.22 111.313 -170.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.8 ttm -86.14 71.22 10.58 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.057 -1.46 . . . . 64.32 107.057 167.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.6 tp . . . . . 0 C--O 1.236 0.368 0 CA-C-N 115.196 -0.911 . . . . 73.04 108.901 -178.725 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 120.478 0.18 . . . . 74.22 111.317 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -60.86 -53.86 52.2 Favored 'General case' 0 N--CA 1.482 1.142 0 O-C-N 123.759 0.662 . . . . 75.53 109.51 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.417 ' O ' HG12 ' A' ' 8' ' ' ILE . 52.8 mt -65.84 -36.53 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.587 -1.188 . . . . 74.03 111.29 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -58.95 -48.17 82.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.542 -0.91 . . . . 75.34 108.542 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -70.21 -42.29 72.51 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-N 115.923 -0.58 . . . . 72.01 111.961 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.4 mt -56.62 -46.26 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.265 0.555 . . . . 74.52 110.892 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 4' ' ' LEU . 35.3 mm -72.72 -42.32 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.397 -0.819 . . . . 73.34 111.023 -176.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -64.34 -53.99 39.96 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.351 0.261 . . . . 73.11 110.453 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.9 mt -57.02 -51.5 69.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.925 0.89 . . . . 73.13 111.263 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.426 ' HA3' HG23 ' A' ' 39' ' ' ILE . . . -64.59 -32.04 82.88 Favored Glycine 0 C--N 1.344 1.021 0 O-C-N 123.907 0.755 . . . . 51.24 113.714 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.5 -44.99 56.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 122.689 -0.301 . . . . 74.34 110.632 176.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.443 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 75.3 t -59.31 -35.89 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.309 0.643 . . . . 75.22 109.893 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.545 HG23 HG23 ' A' ' 35' ' ' VAL . 29.6 mt -57.5 -54.36 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.464 1.105 . . . . 75.44 109.882 171.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -53.85 -34.93 60.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.941 0.896 . . . . 64.34 111.463 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -77.45 -47.22 20.27 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 112.266 0.469 . . . . 73.11 112.266 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.3 ptp180 -83.76 -17.24 41.83 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 112.851 0.686 . . . . 74.15 112.851 -173.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.08 -24.87 67.58 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.035 0.534 . . . . 61.13 111.671 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.8 -7.16 49.36 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.146 0.424 . . . . 74.54 112.146 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -61.14 -21.6 63.9 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.485 0.714 . . . . 74.01 111.612 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 21.6 mmt -67.78 88.57 0.25 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 124.013 0.821 . . . . 74.54 109.891 176.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.468 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 0.2 OUTLIER -69.93 -30.73 68.19 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.462 0.649 . . . . 75.01 109.901 170.343 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HB3' ' A' ' 21' ' ' MET . 53.0 m-85 -106.44 172.87 6.58 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.256 1.022 . . . . 75.33 108.472 167.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 66.4 m 58.95 73.91 0.46 Allowed 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.456 0.646 . . . . 75.34 110.705 -170.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.99 -59.49 2.88 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.715 1.206 . . . . 73.3 110.665 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.605 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 45.8 mmtm -68.33 -29.07 67.73 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 114.439 -1.255 . . . . 74.41 110.323 -175.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.419 ' HG2' ' CB ' ' A' ' 97' ' ' LEU . 0.3 OUTLIER -71.88 -40.18 69.11 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 123.611 0.569 . . . . 74.22 111.562 177.275 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.53 -41.32 97.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.315 0.578 . . . . 75.35 109.831 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -77.27 -24.14 51.08 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.093 -0.958 . . . . 75.11 111.487 176.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 137' ' ' ASP . 0.1 OUTLIER -70.13 -57.82 4.51 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 122.077 0.941 . . . . 74.12 109.803 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.94 -44.97 91.21 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.115 -1.857 . . . . 75.11 108.86 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.58 -53.2 48.0 Favored Glycine 0 C--N 1.353 1.477 0 O-C-N 123.877 0.736 . . . . 70.15 113.625 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -63.29 -45.44 91.43 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.219 0.607 . . . . 73.44 111.342 -175.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.589 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.6 mtt-85 -58.35 -58.03 10.31 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 123.763 0.664 . . . . 73.13 110.913 178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.545 HG23 HG23 ' A' ' 14' ' ' ILE . 79.2 t -56.94 -40.21 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.564 0.54 . . . . 75.52 111.358 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.32 -48.39 81.56 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.589 0.356 . . . . 74.42 111.765 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.14 -21.44 61.68 Favored Glycine 0 N--CA 1.47 0.956 0 CA-C-N 116.613 -0.267 . . . . 74.23 113.202 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 61.7 mt -87.02 -52.19 5.58 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.383 0.673 . . . . 74.2 112.442 175.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 24.1 pt -74.23 -42.74 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 118.63 -0.7 . . . . 63.34 111.766 -169.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.442 ' O ' ' HG2' ' A' ' 44' ' ' MET . 53.2 mtmt -56.43 -51.49 80.59 Favored Pre-proline 0 N--CA 1.489 1.483 0 CA-C-O 118.071 -0.966 . . . . 70.51 112.786 -173.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 40' ' ' LYS . 77.8 Cg_exo -51.89 -45.64 37.25 Favored 'Trans proline' 0 C--N 1.4 3.249 0 C-N-CA 122.295 1.997 . . . . 75.02 112.334 174.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.45 HD13 HD22 ' A' ' 45' ' ' LEU . 4.5 mm? -66.39 -33.03 74.79 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.017 -0.992 . . . . 73.25 111.563 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 49.7 mt-10 -70.55 -35.17 72.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.403 0.681 . . . . 73.2 110.401 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -67.93 -47.13 69.57 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.477 0.485 . . . . 73.12 110.498 -178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.45 HD22 HD13 ' A' ' 42' ' ' LEU . 4.2 pp -75.16 -30.87 60.87 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.744 0.418 . . . . 72.5 111.739 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -70.87 -35.43 72.37 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.325 0.65 . . . . 72.52 110.703 175.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 . . . . . 0 N--CA 1.483 1.191 0 C-N-CA 123.177 0.591 . . . . 61.31 110.715 -178.741 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 110.119 -0.326 . . . . 74.33 110.119 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.8 -57.05 13.34 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.078 0.951 . . . . 72.55 111.55 -174.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -70.81 -23.64 62.4 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.816 0.446 . . . . 64.14 111.787 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -48.29 73.27 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.273 -1.01 . . . . 71.23 108.273 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 43.3 m -68.41 -41.73 80.0 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.947 -1.024 . . . . 74.54 111.066 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 62.4 m -61.27 -40.53 94.44 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.307 0.643 . . . . 64.21 110.704 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.458 ' HB3' HD22 ' A' ' 115' ' ' LEU . . . -64.4 -44.69 90.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.98 0.512 . . . . 74.23 110.454 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.486 ' SD ' HD12 ' A' ' 112' ' ' LEU . 22.9 mmt -64.0 -25.86 68.32 Favored 'General case' 0 CA--C 1.558 1.278 0 O-C-N 123.92 0.763 . . . . 75.02 111.844 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -77.14 -44.75 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.843 0.857 . . . . 73.31 110.772 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.5 mtp85 -61.12 -40.6 94.37 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.042 0.937 . . . . 75.12 109.393 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -67.92 -51.61 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 114.099 -1.409 . . . . 75.3 110.002 -177.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.407 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 14.5 tmtt? -54.97 -47.95 73.88 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.933 1.293 . . . . 75.34 110.999 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -65.25 -40.7 94.35 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.687 0.617 . . . . 60.14 111.407 -178.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.456 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -63.54 -41.57 98.44 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.21 0.604 . . . . 64.42 111.248 177.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.405 ' O ' HD13 ' A' ' 14' ' ' ILE . 11.0 mp -65.11 -32.17 73.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.335 0.654 . . . . 73.54 111.675 174.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 50.2 mt-10 -64.74 -40.91 96.12 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.685 0.394 . . . . 73.31 110.974 174.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 47.8 mt-10 -62.54 -49.69 74.29 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.629 0.581 . . . . 74.31 110.031 177.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.458 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.22 -44.02 92.3 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 123.96 0.787 . . . . 63.03 111.103 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -59.92 -44.69 94.16 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.152 1.381 . . . . 74.14 110.77 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.67 -39.43 93.73 Favored Glycine 0 C--N 1.343 0.952 0 CA-C-N 114.996 -1.002 . . . . 74.42 112.32 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -59.97 -57.89 10.9 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.154 0.477 . . . . 54.45 110.302 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -63.55 -23.19 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 112.659 0.614 . . . . 75.24 112.659 177.453 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.413 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 33.4 tt0 -65.16 -44.64 87.9 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.584 0.354 . . . . 73.43 110.921 173.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -87.82 -19.11 27.91 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.513 0.325 . . . . 72.1 111.288 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 11.5 m-30 -82.0 0.84 38.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.43 0.692 . . . . 75.11 111.578 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 74.1 p -57.47 -24.9 58.46 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.316 0.646 . . . . 72.15 110.668 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -85.35 95.59 9.28 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 108.224 -1.028 . . . . 71.54 108.224 168.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.474 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -73.13 -31.63 64.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.715 0.806 . . . . 74.31 112.064 -169.434 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.8 p -74.11 -32.89 63.39 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.978 0.511 . . . . 72.33 110.803 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -66.43 -32.91 74.58 Favored 'General case' 0 C--O 1.249 1.06 0 C-N-CA 123.756 0.822 . . . . 70.5 109.964 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 36.9 mt -55.88 -53.05 42.38 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 109.017 -0.734 . . . . 74.42 109.017 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . 0.472 ' HB2' ' CE1' ' A' ' 148' ' ' PHE . 42.8 t -57.05 -39.35 74.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.909 0.884 . . . . 64.33 111.747 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -58.68 -51.24 70.78 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 114.994 -1.003 . . . . 72.05 110.891 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.41 -23.14 50.67 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.677 0.391 . . . . 72.13 110.831 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -72.21 -47.18 52.47 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.974 0.91 . . . . 74.43 110.506 -172.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -63.12 -29.04 70.48 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.838 -0.619 . . . . 75.12 110.415 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.41 61.03 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.59 0.756 . . . . 74.24 111.029 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 123.757 0.823 . . . . 73.31 109.899 179.591 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 2.5 mp . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 107.45 -1.315 . . . . 73.44 107.45 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.419 ' CB ' ' HG2' ' A' ' 27' ' ' GLN . 13.5 tp -69.57 -32.85 71.86 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.44 0.638 . . . . 63.22 111.157 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -109.21 16.76 22.22 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 115.033 -0.985 . . . . 74.2 111.669 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.458 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 85.6 tttt -42.54 -57.35 2.7 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.96 1.467 . . . . 75.01 114.96 -163.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.67 -48.7 65.89 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.906 0.882 . . . . 74.33 111.255 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 77.2 t -61.72 -52.72 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.948 0.899 . . . . 73.44 110.978 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -68.35 -26.32 65.53 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.873 1.269 . . . . 72.35 110.712 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.451 ' NH1' ' HB2' ' A' ' 107' ' ' ASP . 15.3 tpt180 -61.35 -43.59 98.61 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.446 0.699 . . . . 73.02 109.845 168.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -60.26 -49.77 76.29 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 119.046 -0.502 . . . . 71.34 111.577 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.456 HD11 ' HB1' ' A' ' 68' ' ' ALA . 8.8 mp -55.33 -37.84 67.96 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-N 118.607 0.639 . . . . 74.34 111.261 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.589 ' HB2' HH12 ' A' ' 34' ' ' ARG . 32.9 t -67.13 -53.03 34.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.804 0.842 . . . . 74.21 111.12 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.574 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 5.7 t70 -78.43 -29.23 46.95 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.745 -0.661 . . . . 74.21 111.146 -170.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.407 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 70.3 t -79.46 -27.38 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.947 0.499 . . . . 73.51 110.165 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -65.45 -39.73 92.37 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 118.717 0.69 . . . . 73.51 110.21 168.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.574 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 49.2 mtpt -54.92 -59.05 5.27 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 123.494 0.496 . . . . 73.41 109.793 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 50.0 mt-10 -53.45 -47.96 69.26 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.523 1.14 . . . . 62.13 110.568 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.486 HD12 ' SD ' ' A' ' 62' ' ' MET . 2.6 tp -57.91 -59.66 4.9 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.382 1.073 . . . . 74.3 109.592 -173.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.3 t -55.08 -41.41 71.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.675 1.19 . . . . 75.43 112.103 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.41 -47.21 67.87 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.074 -0.512 . . . . 73.52 111.996 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 4.2 pp -78.4 -19.29 53.6 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.818 -0.551 . . . . 74.22 111.43 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.425 ' HG ' ' HE2' ' A' ' 122' ' ' MET . 2.0 mp -63.46 -53.36 53.31 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.923 -0.769 . . . . 65.11 108.923 169.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -72.18 -27.69 62.72 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.651 0.38 . . . . 73.05 112.024 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.93 -63.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.852 0.461 . . . . 75.22 110.956 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -85.36 -58.23 2.76 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.486 0.715 . . . . 74.53 111.484 -165.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -88.55 -2.97 58.89 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.284 0.634 . . . . 75.25 110.318 -176.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 54.85 35.85 25.21 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.73 1.612 . . . . 72.51 112.363 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.425 ' HE2' ' HG ' ' A' ' 116' ' ' LEU . 27.7 mtm -95.66 129.3 34.97 Favored Pre-proline 0 N--CA 1.477 0.917 0 O-C-N 121.669 -0.644 . . . . 70.54 110.336 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo . . . . . 0 C--N 1.37 1.698 0 C-N-CA 123.523 2.815 . . . . 53.13 112.11 -175.59 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.427 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 22.0 m0 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 113.753 1.02 . . . . 73.52 113.753 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.77 -25.26 48.94 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 120.796 0.331 . . . . 75.32 111.557 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -89.71 -50.83 5.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.738 0.815 . . . . 71.34 111.126 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.427 ' HG2' ' HA ' ' A' ' 133' ' ' TRP . 11.5 pt-20 -57.05 -42.33 80.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.528 0.731 . . . . 72.1 111.754 -174.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.0 OUTLIER -60.09 -51.26 70.36 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.152 0.581 . . . . 63.32 112.012 -177.355 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.42 -39.27 77.97 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.219 0.324 . . . . 64.45 111.515 -175.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -66.99 -57.91 5.97 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.642 0.734 . . . . 74.32 111.3 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.605 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 1.2 m-20 -55.53 -51.92 65.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.194 -1.366 . . . . 73.4 111.119 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -66.93 -27.26 67.34 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.286 0.476 . . . . 73.31 112.286 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -58.83 -58.45 8.58 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.102 -0.703 . . . . 74.03 109.102 172.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.58 -25.15 65.63 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.802 -1.544 . . . . 72.23 111.609 -177.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.2 t0 -84.51 -42.26 15.71 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.634 0.774 . . . . 75.43 111.898 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.751 0.82 . . . . 74.01 109.13 170.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -61.79 -43.96 97.82 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.409 -1.269 . . . . 74.11 110.773 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.1 -18.08 60.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.331 0.653 . . . . 72.44 112.325 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.472 ' CE1' ' HB2' ' A' ' 86' ' ' CYS . 0.5 OUTLIER -78.42 -60.81 2.22 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.967 -0.753 . . . . 73.22 108.967 176.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -73.73 -51.27 17.08 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.803 -1.09 . . . . 74.24 110.866 -171.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 28.4 mmt -101.82 51.74 0.83 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.065 -0.716 . . . . 73.13 109.065 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.475 0.796 0 CA-C-N 115.152 -0.931 . . . . 73.32 109.443 -176.162 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 120.547 0.213 . . . . 63.35 111.247 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -67.76 -38.25 83.2 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.863 -0.608 . . . . 73.22 109.694 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 42' ' ' LEU . 31.6 tp -69.23 -36.52 77.28 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.134 -0.939 . . . . 72.21 110.734 176.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.444 ' HG2' ' OE1' ' A' ' 46' ' ' GLN . 3.2 tmtp? -63.6 -42.44 98.23 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 108.612 -0.885 . . . . 73.42 108.612 177.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -58.41 -44.74 89.14 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.291 0.994 . . . . 70.31 110.765 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 82.1 mt -54.31 -50.94 52.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 124.191 0.996 . . . . 74.14 111.077 174.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 4' ' ' LEU . 24.9 mm -63.27 -43.71 98.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.989 0.916 . . . . 75.42 111.02 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.8 m -64.15 -48.55 75.57 Favored 'General case' 0 C--N 1.348 0.511 0 O-C-N 123.966 0.791 . . . . 74.41 110.325 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.0 -45.87 86.15 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 124.025 0.828 . . . . 73.43 110.72 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.56 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -59.97 -46.05 94.82 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 124.346 1.029 . . . . 71.14 113.027 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -63.38 -49.63 73.07 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 122.56 0.344 . . . . 64.33 110.627 178.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.48 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 84.3 t -60.84 -33.15 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.759 0.824 . . . . 74.12 110.932 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.438 HG21 HG23 ' A' ' 35' ' ' VAL . 17.3 mt -57.82 -54.68 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.179 0.992 . . . . 72.54 109.007 174.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -62.2 -31.28 71.79 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.013 0.82 . . . . 72.01 111.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.86 -59.95 3.08 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.719 0.407 . . . . 73.53 111.172 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 16.4 ptp180 -73.34 -16.56 61.36 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 112.621 0.6 . . . . 70.34 112.621 -175.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 46.1 t -66.72 -22.83 66.05 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.305 0.642 . . . . 72.1 110.864 173.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -76.34 2.91 12.14 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 65.13 111.836 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -86.54 -1.22 57.45 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.536 0.734 . . . . 75.04 111.978 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 15.0 mmt -80.81 95.9 6.82 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.912 0.387 . . . . 74.44 110.987 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.619 ' HB3' ' HG2' ' A' ' 82' ' ' ARG . 12.1 tptt -67.97 -41.1 82.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.546 1.138 . . . . 65.13 110.014 170.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -97.17 -178.66 4.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 114.979 -1.01 . . . . 72.4 109.225 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.9 p 46.68 62.35 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.768 1.227 . . . . 74.23 111.608 175.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 22' ' ' LYS . 32.8 mmtp -73.39 -38.95 65.46 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.58 -1.191 . . . . 74.43 111.742 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.444 ' HG2' ' HA ' ' A' ' 140' ' ' ASP . 58.8 tptt -63.26 -47.67 81.42 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.832 -1.174 . . . . 74.11 107.832 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -46.82 -54.37 10.01 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.848 1.659 . . . . 72.43 111.129 175.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.415 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 20.4 t -62.17 -50.78 70.47 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.725 1.21 . . . . 64.03 112.88 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -73.6 -37.75 65.33 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.207 0.603 . . . . 74.12 111.8 -171.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -81.15 -28.13 35.19 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.304 0.377 . . . . 74.41 110.066 -178.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.403 HD23 ' SG ' ' A' ' 18' ' ' CYS . 69.2 tp -62.26 -51.13 68.98 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 108.262 -1.014 . . . . 72.12 108.262 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.1 -36.2 91.98 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 124.152 0.908 . . . . 72.41 113.089 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -64.49 -53.92 40.61 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 124.031 0.933 . . . . 74.25 110.348 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -46.9 -60.69 2.27 Favored 'General case' 0 C--N 1.367 1.362 0 O-C-N 124.992 1.433 . . . . 71.13 109.282 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.438 HG23 HG21 ' A' ' 14' ' ' ILE . 48.2 t -57.64 -48.1 84.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 125.182 1.393 . . . . 74.54 112.596 -171.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.5 mt -65.48 -50.13 66.46 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 118.442 0.565 . . . . 74.04 110.726 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.12 -19.66 66.25 Favored Glycine 0 C--N 1.351 1.405 0 O-C-N 123.78 0.675 . . . . 74.25 112.752 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.547 HD13 ' HZ ' ' A' ' 65' ' ' PHE . 19.2 tp -84.46 -50.32 7.86 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.571 1.148 . . . . 73.43 111.974 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.56 HG21 ' HA3' ' A' ' 11' ' ' GLY . 10.1 pt -79.21 -30.95 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.1 0.56 . . . . 71.25 111.221 -171.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.521 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 15.4 tppt? -58.68 -53.98 60.85 Favored Pre-proline 0 CA--C 1.567 1.608 0 CA-C-O 118.031 -0.985 . . . . 74.24 113.033 -174.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -61.17 -31.09 89.8 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 121.613 1.542 . . . . 75.03 112.303 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.58 ' HB3' HD13 ' A' ' 4' ' ' LEU . 4.3 mm? -78.03 -36.55 48.45 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.448 0.699 . . . . 74.03 111.24 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.535 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 12.0 pt-20 -77.79 -20.34 53.47 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 119.192 -0.432 . . . . 72.55 111.574 -177.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.0 mmt -60.53 -56.31 22.87 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.45 0.469 . . . . 64.02 110.681 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 pp -72.64 -30.83 64.64 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.1 0.56 . . . . 75.21 111.437 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.535 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.0 OUTLIER -64.03 -44.61 92.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.507 0.723 . . . . 75.14 111.051 175.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 N--CA 1.485 1.32 0 C-N-CA 123.864 0.866 . . . . 71.24 111.121 -178.452 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.1 m . . . . . 0 CA--C 1.554 1.131 0 N-CA-C 111.79 0.293 . . . . 71.3 111.79 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -62.67 -37.91 88.26 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.822 0.449 . . . . 72.45 111.011 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -67.49 -31.6 71.85 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.334 0.654 . . . . 72.54 111.031 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.09 -50.74 63.02 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.105 0.562 . . . . 75.42 109.522 174.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 m -58.39 -48.68 79.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.174 0.99 . . . . 72.11 111.228 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -61.76 -43.97 97.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.057 0.943 . . . . 75.45 110.671 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.54 98.82 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.857 0.723 . . . . 73.25 110.928 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.455 ' HE2' HD11 ' A' ' 112' ' ' LEU . 31.2 mmt -64.38 -43.03 95.75 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.507 0.723 . . . . 74.42 110.694 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.6 -39.57 88.46 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 124.004 0.922 . . . . 75.32 111.3 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.413 ' NE ' HG22 ' A' ' 108' ' ' VAL . 49.7 ttt85 -72.34 -38.07 68.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.583 1.553 . . . . 75.31 111.002 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.547 ' HZ ' HD13 ' A' ' 38' ' ' LEU . 2.4 t80 -73.87 -43.77 57.52 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.896 -1.047 . . . . 70.12 109.515 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.0 ttpp -55.97 -47.42 77.69 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 114.288 -1.323 . . . . 75.42 109.925 172.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.87 92.2 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.826 0.85 . . . . 74.41 111.643 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.512 ' HB3' HD11 ' A' ' 105' ' ' LEU . . . -61.02 -42.3 98.2 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 115.421 -0.809 . . . . 74.43 110.978 175.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.02 -26.7 62.32 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.378 0.671 . . . . 73.11 111.852 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 97.8 mt-10 -65.58 -43.81 88.6 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 108.664 -0.865 . . . . 75.44 108.664 175.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 50.8 mt-10 -61.03 -52.69 63.92 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.741 -1.118 . . . . 74.43 110.365 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.91 -45.99 82.26 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 124.085 0.866 . . . . 74.05 111.454 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.08 -36.04 80.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.513 1.125 . . . . 71.5 110.28 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 77' ' ' GLU . . . -69.38 -36.02 77.22 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.289 -0.869 . . . . 74.12 112.881 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 14.4 mm-40 -65.33 -55.41 18.38 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.528 0.664 . . . . 74.22 110.041 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' ' 72' ' ' ALA . 1.2 pt -64.2 -27.06 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 112.581 0.586 . . . . 75.53 112.581 176.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 74' ' ' GLY . 11.3 tt0 -56.39 -49.13 75.36 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.957 0.503 . . . . 72.54 110.669 169.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -78.03 -28.89 49.15 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.188 0.595 . . . . 74.25 110.968 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 19.2 m-30 -81.05 -5.8 58.05 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.767 0.827 . . . . 72.24 112.323 -178.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 97.1 p -60.14 -33.06 71.64 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.413 -0.588 . . . . 63.13 109.413 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -82.66 109.13 16.57 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.678 -1.23 . . . . 63.34 107.678 165.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.619 ' HG2' ' HB3' ' A' ' 22' ' ' LYS . 3.4 mpt_? -74.53 -25.65 59.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.25 0.62 . . . . 71.11 111.645 -172.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.3 m -62.84 -37.3 86.25 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.839 0.856 . . . . 71.14 110.592 174.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -60.35 -39.22 86.37 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 124.371 1.068 . . . . 75.2 111.072 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.409 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 26.0 mt -59.64 -53.96 41.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.201 0 O-C-N 123.829 0.706 . . . . 74.2 109.653 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 16.9 t -62.07 -38.05 87.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.13 0.572 . . . . 72.21 111.717 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.3 tpp180 -59.86 -47.88 83.97 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.389 1.076 . . . . 75.52 110.96 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.81 -22.39 40.07 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 116.15 -0.477 . . . . 75.01 110.555 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 17.3 tp -71.81 -41.24 68.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.776 0.831 . . . . 72.42 110.717 -173.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -71.22 -21.37 62.14 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.896 -0.593 . . . . 75.43 110.565 176.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.75 10.94 32.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.156 0.983 . . . . 70.31 111.058 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 C--N 1.357 0.916 0 C-N-CA 123.14 0.576 . . . . 74.43 110.718 -174.879 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.785 HG13 ' HB3' ' A' ' 141' ' ' ALA . 1.4 mp . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.15 -1.055 . . . . 70.25 108.15 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.93 -46.84 22.82 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.909 0.862 . . . . 74.01 108.792 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -98.51 34.6 1.98 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.152 -1.386 . . . . 73.52 110.455 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.634 ' HG3' HD13 ' A' ' 96' ' ' ILE . 22.1 ttpt -52.58 -65.2 0.6 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.735 0.698 . . . . 75.24 112.058 -172.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -65.92 -47.85 73.39 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.82 0.7 . . . . 74.54 110.558 -173.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 84.4 t -60.7 -57.82 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 124.287 0.992 . . . . 72.0 111.951 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -72.32 -24.16 61.27 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.811 0.844 . . . . 75.15 111.273 -174.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -66.94 -35.9 81.03 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.95 -0.389 . . . . 74.5 109.95 168.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -69.67 -37.81 76.83 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 119.113 -0.47 . . . . 73.31 110.64 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.512 HD11 ' HB3' ' A' ' 68' ' ' ALA . 10.9 mp -55.61 -45.2 77.54 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.553 -0.536 . . . . 74.2 109.553 171.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -63.11 -53.86 46.9 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 124.127 0.892 . . . . 71.42 110.885 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -60.7 -52.92 63.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.549 1.14 . . . . 70.43 111.508 -174.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.413 HG22 ' NE ' ' A' ' 64' ' ' ARG . 59.1 t -63.02 -42.97 98.69 Favored 'Isoleucine or valine' 0 C--N 1.344 0.346 0 O-C-N 124.07 0.856 . . . . 73.12 110.345 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -61.76 -35.24 77.55 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.374 0.422 . . . . 73.33 111.403 177.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 57.6 mtpt -61.24 -55.35 32.99 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.712 -0.477 . . . . 74.14 109.712 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.1 -41.48 75.31 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.007 0.923 . . . . 74.01 111.05 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 3.7 tt -75.0 -47.78 27.42 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 114.115 -1.402 . . . . 72.04 110.45 -170.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.3 p -65.22 -33.41 75.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.222 0.609 . . . . 63.43 110.541 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.419 ' O ' HG23 ' A' ' 118' ' ' VAL . 80.0 mt -60.21 -57.13 14.12 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.892 0.745 . . . . 71.24 110.453 172.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.12 -23.77 67.23 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 111.801 0.297 . . . . 74.24 111.801 -178.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.7 mt -70.28 -45.58 66.06 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.876 -0.416 . . . . 72.34 109.876 171.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.418 ' O ' ' HA ' ' A' ' 121' ' ' ARG . 30.0 tt0 -77.13 -19.71 56.54 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.611 0.764 . . . . 71.45 111.185 -174.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 114' ' ' LEU . 64.1 t -91.36 -56.42 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 122.947 0.499 . . . . 74.34 110.288 177.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -73.51 -59.13 2.86 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.082 0.468 . . . . 71.44 110.736 -175.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -84.93 -16.43 41.1 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.588 -0.733 . . . . 72.33 110.767 -175.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 60.4 mtm-85 57.14 44.16 22.86 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.443 1.097 . . . . 74.22 110.013 -175.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.462 ' SD ' HD11 ' A' ' 116' ' ' LEU . 44.7 ttm -70.86 127.42 91.79 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 114.637 -1.165 . . . . 73.22 111.081 -174.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 6.3 Cg_exo . . . . . 0 C--N 1.371 1.727 0 C-N-CA 122.729 2.286 . . . . 73.41 109.846 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 112.292 0.479 . . . . 74.32 112.292 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -84.0 -34.08 24.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.0 0.52 . . . . 61.5 111.492 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -80.0 -33.05 39.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.897 0.879 . . . . 74.22 111.584 -173.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -59.88 -37.54 79.65 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 123.492 0.495 . . . . 64.34 109.825 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.87 -37.71 83.06 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.628 1.171 . . . . 75.35 111.573 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -68.84 -50.31 51.1 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.265 0.353 . . . . 73.03 111.287 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.1 -42.02 93.78 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 123.806 0.691 . . . . 74.02 110.481 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.444 ' HA ' ' HG2' ' A' ' 26' ' ' LYS . 1.4 t70 -60.7 -54.1 49.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.052 1.741 . . . . 63.21 110.918 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.785 ' HB3' HG13 ' A' ' 96' ' ' ILE . . . -53.98 -53.02 58.61 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.13 -1.396 . . . . 74.2 112.067 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.57 -45.33 85.32 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.1 -1.409 . . . . 73.32 111.114 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.22 -52.47 58.63 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 124.728 1.268 . . . . 53.21 111.159 -172.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.51 -38.01 68.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 124.022 0.826 . . . . 73.11 111.725 -174.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' A' ' 149' ' ' GLN . 0.0 OUTLIER -57.41 -50.23 73.68 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.498 0.499 . . . . 73.53 109.891 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . 0.409 ' N ' ' HD3' ' A' ' 145' ' ' ARG . 5.7 tmm_? -71.47 -31.19 66.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.501 0.72 . . . . 71.3 110.035 -176.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.2 -19.83 53.09 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.189 0.596 . . . . 62.22 111.675 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -80.42 -50.94 9.43 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.772 -0.825 . . . . 75.15 108.772 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 145' ' ' ARG . 25.1 mm-40 -60.82 -60.19 4.19 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.902 0.752 . . . . 63.21 109.581 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.467 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 5.9 mmt -99.8 66.67 1.41 Allowed 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.361 1.064 . . . . 65.13 109.071 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 C--N 1.351 0.672 0 CA-C-O 121.986 0.898 . . . . 71.44 109.864 179.67 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.493 0.187 . . . . 64.31 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -68.88 -36.75 78.47 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 116.023 -0.535 . . . . 71.35 111.265 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.424 ' O ' HD11 ' A' ' 8' ' ' ILE . 4.1 mm? -62.97 -47.26 83.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.544 0.337 . . . . 74.45 110.519 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HA ' ' NE2' ' A' ' 46' ' ' GLN . 51.8 tptt -57.42 -43.27 83.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.309 0.644 . . . . 73.15 109.829 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -61.57 -63.98 1.09 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-O 118.385 -0.816 . . . . 72.32 111.085 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.0 mt -47.98 -45.59 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.094 0.958 . . . . 74.24 112.917 -174.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.463 ' HB ' ' NE2' ' A' ' 46' ' ' GLN . 1.7 mp -70.92 -48.55 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 115.647 -0.706 . . . . 64.55 110.987 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.1 m -61.62 -48.55 80.37 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 123.179 0.299 . . . . 74.34 110.305 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -57.19 -45.02 84.11 Favored 'General case' 0 C--O 1.208 -1.118 0 C-N-CA 124.648 1.179 . . . . 74.03 110.949 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.404 ' HA3' HG23 ' A' ' 39' ' ' ILE . . . -63.15 -42.29 99.49 Favored Glycine 0 C--N 1.347 1.167 0 O-C-N 124.244 0.965 . . . . 72.43 113.075 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -65.13 -43.24 92.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.198 0.599 . . . . 75.22 111.753 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -76.03 -25.29 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.619 0.767 . . . . 75.44 110.541 -178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.46 -51.77 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.841 0.856 . . . . 74.11 108.877 171.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -61.32 -36.54 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 124.12 0.888 . . . . 74.33 110.335 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -56.02 19.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.428 1.091 . . . . 74.21 110.56 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HD2' HG13 ' A' ' 76' ' ' ILE . 5.2 ptp180 -75.84 -16.28 60.1 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.679 -0.691 . . . . 72.13 111.723 -178.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.558 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 48.2 t -72.15 -21.53 61.44 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.29 0.636 . . . . 70.24 110.54 172.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -81.18 0.01 38.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.502 0.721 . . . . 74.45 111.979 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.5 -29.73 70.41 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.457 -0.572 . . . . 62.21 109.457 165.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.523 ' HE2' HG21 ' A' ' 76' ' ' ILE . 5.1 mmt -71.15 89.57 0.85 Allowed 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.066 -0.516 . . . . 73.22 109.623 -178.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -75.25 -27.21 59.37 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 108.496 -0.927 . . . . 72.32 108.496 170.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -93.33 172.32 8.36 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.597 1.159 . . . . 74.43 108.319 163.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.46 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 28.5 m 51.93 48.69 22.27 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.275 0.56 . . . . 53.25 110.878 -176.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.412 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 94.5 mttt -63.78 -41.04 98.02 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.047 -0.978 . . . . 72.43 111.035 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.533 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 0.5 OUTLIER -75.97 -22.92 55.4 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.958 -0.565 . . . . 74.4 109.735 -176.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.605 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 11.7 mm-40 -69.47 -40.56 77.02 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 123.005 0.522 . . . . 75.13 110.665 168.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.558 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 41.9 t -59.25 -42.63 91.55 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.359 0.663 . . . . 73.21 110.001 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.412 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 11.5 mpt_? -77.12 -30.31 55.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.429 -0.805 . . . . 74.44 111.859 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 ttp85 -71.39 -60.03 2.45 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.369 0.668 . . . . 70.23 110.453 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.444 HD21 ' SG ' ' A' ' 18' ' ' CYS . 46.9 tp -56.61 -43.8 80.51 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.714 -1.13 . . . . 74.21 109.978 174.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.09 -49.12 74.27 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.103 0.877 . . . . 73.43 113.192 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -60.95 -47.76 84.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.811 0.845 . . . . 73.43 110.903 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.455 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 31.5 mtt180 -60.59 -60.33 3.98 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.093 0.871 . . . . 72.21 111.286 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.91 -45.07 75.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 124.306 1.004 . . . . 73.21 111.528 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.49 -44.16 97.57 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.623 0.577 . . . . 74.51 110.752 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.09 -25.82 71.14 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 123.517 0.511 . . . . 62.13 113.521 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 40.8 mt -79.96 -49.8 11.34 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.385 0.674 . . . . 74.13 110.983 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.432 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 10.5 pt -74.43 -33.69 33.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 CA-C-O 118.372 -0.823 . . . . 73.52 111.224 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -44.53 -58.61 4.95 Favored Pre-proline 0 N--CA 1.503 2.2 0 C-N-CA 124.914 1.286 . . . . 71.2 113.87 -170.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.452 ' HG2' HD22 ' A' ' 42' ' ' LEU . 35.0 Cg_endo -62.72 -42.05 27.69 Favored 'Trans proline' 0 C--N 1.401 3.338 0 C-N-CA 121.383 1.389 . . . . 75.34 110.692 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HB3' HD13 ' A' ' 8' ' ' ILE . 3.6 mm? -70.11 -20.2 63.2 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.571 0.748 . . . . 74.35 111.499 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.44 ' HG2' HG22 ' A' ' 8' ' ' ILE . 63.7 mt-10 -73.62 -45.31 53.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.796 0.839 . . . . 74.53 109.561 175.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.459 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 26.4 mmt -62.4 -33.18 74.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.659 -0.7 . . . . 72.53 110.802 174.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.09 -21.06 36.97 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.007 0.923 . . . . 74.32 111.847 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.517 ' NE2' ' HA ' ' A' ' 5' ' ' LYS . 33.5 tt0 -75.27 -38.11 60.6 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.765 0.426 . . . . 61.11 110.042 173.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 N--CA 1.477 0.893 0 C-N-CA 123.391 0.677 . . . . 71.04 110.407 176.332 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 110.389 -0.226 . . . . 73.54 110.389 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.47 -32.14 73.32 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 110.168 -0.308 . . . . 72.11 110.168 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -71.77 -30.87 66.03 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.487 0.315 . . . . 74.31 111.132 175.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.1 -51.21 57.08 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 107.883 -1.155 . . . . 73.44 107.883 176.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.1 m -58.06 -47.59 82.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.454 1.102 . . . . 75.14 111.198 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.4 m -65.88 -40.9 92.04 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.768 0.827 . . . . 75.23 111.14 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.68 96.34 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.803 0.441 . . . . 74.14 110.283 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.51 -26.67 64.65 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.105 0.562 . . . . 64.1 111.261 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.519 ' HA ' ' HE2' ' A' ' 66' ' ' LYS . 84.8 m-20 -76.44 -38.28 55.73 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.466 0.706 . . . . 73.34 110.632 176.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.19 -39.51 78.64 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.737 0.815 . . . . 74.33 109.811 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.414 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -67.62 -49.0 65.17 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.286 1.034 . . . . 72.24 109.014 -177.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.519 ' HE2' ' HA ' ' A' ' 63' ' ' ASN . 37.1 ttpt -55.59 -46.1 77.3 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.054 1.342 . . . . 74.13 111.754 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.41 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -70.56 -32.22 69.55 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.463 0.705 . . . . 75.11 111.454 -177.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.484 ' HB2' HD11 ' A' ' 105' ' ' LEU . . . -71.02 -32.43 69.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.356 0.662 . . . . 74.31 109.885 175.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 95.1 mt -73.11 -27.59 61.78 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.595 -0.73 . . . . 74.21 110.502 173.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -66.55 -41.78 88.16 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.777 0.431 . . . . 74.03 110.637 171.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 16.5 mm-40 -60.58 -49.29 78.13 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.63 0.581 . . . . 72.33 109.977 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.496 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.18 -46.8 88.47 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.9 0.75 . . . . 73.42 111.264 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.19 -47.53 78.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.5 1.12 . . . . 74.23 110.599 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.73 -37.73 94.72 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.083 -0.962 . . . . 63.2 112.878 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -61.46 -53.07 61.3 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.0 0.52 . . . . 72.21 110.978 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.555 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -69.12 -20.31 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 N-CA-C 112.239 0.459 . . . . 75.11 112.239 179.305 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -67.26 -41.03 86.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.262 0.553 . . . . 71.52 111.055 168.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -71.97 -30.23 65.06 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.127 -0.942 . . . . 73.42 110.816 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.539 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.4 m-85 -83.97 -8.17 59.22 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.741 0.817 . . . . 74.31 112.271 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 9.1 t -61.9 -22.11 65.3 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.241 0.543 . . . . 73.45 110.291 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -86.05 108.55 18.31 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.212 -1.033 . . . . 73.12 108.212 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -75.54 -23.84 56.67 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.864 0.465 . . . . 74.35 110.595 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.1 m -67.9 -35.0 77.72 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.131 0.572 . . . . 74.42 110.58 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -64.07 -38.3 90.58 Favored 'General case' 0 C--O 1.25 1.11 0 C-N-CA 123.209 0.604 . . . . 73.33 110.096 175.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.483 HG21 HD11 ' A' ' 97' ' ' LEU . 32.8 mt -59.81 -56.73 15.42 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 123.816 0.698 . . . . 74.43 109.177 174.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -56.54 -38.22 71.56 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.361 0.664 . . . . 74.12 111.762 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 ttm180 -56.05 -59.18 5.28 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 124.664 1.228 . . . . 75.51 111.028 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.75 -25.6 56.67 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 116.058 -0.519 . . . . 75.42 110.206 -175.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.409 HD21 HE21 ' A' ' 149' ' ' GLN . 16.6 tp -74.13 -41.33 61.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.547 0.739 . . . . 74.51 110.03 -169.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -66.17 -22.76 66.37 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 123.434 0.459 . . . . 73.4 110.598 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 -28.91 19.2 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.056 0.943 . . . . 64.04 111.546 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.4 p . . . . . 0 N--CA 1.475 0.809 0 C-N-CA 122.917 0.487 . . . . 71.04 111.34 -174.01 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.405 HD11 ' HA ' ' A' ' 138' ' ' GLN . 3.0 mp . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 108.664 -0.865 . . . . 65.11 108.664 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.605 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 9.3 tp -56.48 -30.37 62.87 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 124.329 1.018 . . . . 71.34 112.074 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.555 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 28.1 m-85 -121.57 26.94 8.5 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 114.616 -1.174 . . . . 74.54 111.716 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -40.03 -63.71 0.58 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.398 1.079 . . . . 74.34 112.183 -169.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.48 -61.55 2.51 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.581 1.152 . . . . 72.13 111.86 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 96.9 t -59.79 -56.32 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.681 1.192 . . . . 72.21 111.685 -172.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.45 ' HB2' ' HB3' ' A' ' 98' ' ' PHE . 50.7 t30 -61.07 -33.63 73.64 Favored 'General case' 0 C--O 1.245 0.864 0 C-N-CA 124.926 1.29 . . . . 74.33 112.517 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -41.36 97.31 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 109.47 -0.567 . . . . 75.31 109.47 172.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -68.85 -31.9 71.19 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.786 -0.643 . . . . 73.44 112.442 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.484 HD11 ' HB2' ' A' ' 68' ' ' ALA . 10.4 mp -58.81 -49.36 78.0 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.533 -0.543 . . . . 73.51 109.533 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.7 t -66.51 -32.77 74.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.806 0.842 . . . . 72.45 111.52 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 15.0 t70 -70.19 -51.39 31.47 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.656 0.783 . . . . 74.32 110.433 -178.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.5 -27.67 37.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-N 116.042 -0.526 . . . . 73.1 110.337 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 48.5 t-105 -69.42 -37.15 77.3 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 122.804 0.442 . . . . 75.34 111.462 174.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 32.5 pttt -66.49 -40.04 89.07 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 108.217 -1.031 . . . . 74.21 108.217 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 42.0 mt-10 -60.56 -47.96 83.87 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 123.526 0.516 . . . . 74.34 110.41 174.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -61.36 2.46 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 124.842 1.339 . . . . 75.51 108.718 -177.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.4 t -49.26 -43.41 42.92 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.03 1.332 . . . . 72.33 111.274 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -58.3 -66.15 0.53 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 123.832 0.708 . . . . 74.43 111.896 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.9 pp -62.93 -27.68 69.55 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.241 0.46 . . . . 74.41 112.241 -172.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HB3' ' HE2' ' A' ' 122' ' ' MET . 95.1 mt -70.69 -48.36 55.11 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.067 0.947 . . . . 73.44 110.673 176.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -78.83 -20.68 49.06 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.508 0.323 . . . . 74.13 111.644 -175.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.1 -55.38 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 110.014 -0.365 . . . . 63.51 110.014 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -87.56 -58.52 2.55 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 111.729 0.27 . . . . 62.21 111.729 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -76.81 -8.02 56.53 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.417 0.287 . . . . 74.52 111.239 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 58.31 32.88 22.6 Favored 'General case' 0 C--N 1.36 1.027 0 C-N-CA 124.621 1.168 . . . . 74.44 111.243 177.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.477 ' HE2' ' HB3' ' A' ' 116' ' ' LEU . 35.0 ttm -72.24 124.92 91.47 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 114.93 -1.032 . . . . 75.12 110.921 -174.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo . . . . . 0 C--N 1.367 1.533 0 C-N-CA 122.463 2.109 . . . . 74.53 110.984 178.327 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.7 m0 . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 114.258 1.207 . . . . 75.43 114.258 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.44 -39.48 46.67 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.672 0.272 . . . . 73.44 110.981 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -67.37 -47.73 69.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.656 0.782 . . . . 74.01 110.181 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.45 -63.04 1.37 Allowed 'General case' 0 C--N 1.355 0.809 0 CA-C-N 114.412 -1.267 . . . . 73.15 110.636 -170.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -56.21 -38.66 71.31 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.736 1.272 . . . . 74.21 112.66 -176.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . 0.405 ' HA ' HD11 ' A' ' 96' ' ' ILE . 6.4 tp-100 -58.18 -60.42 3.78 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.085 0.865 . . . . 75.53 110.43 178.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -68.73 -39.63 80.27 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.562 -0.745 . . . . 75.34 111.362 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.93 -57.98 10.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.929 1.692 . . . . 72.51 110.029 -177.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.29 -25.03 57.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 114.226 -1.352 . . . . 74.12 112.252 -174.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . 0.469 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 22.0 t70 -61.09 -56.05 25.38 Favored 'General case' 0 C--N 1.349 0.58 0 O-C-N 123.724 0.64 . . . . 72.11 109.315 172.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.84 -33.36 75.8 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.488 1.117 . . . . 74.3 111.695 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.533 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 25.5 t0 -74.15 -32.63 63.22 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.197 0.311 . . . . 74.23 111.114 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -67.07 -37.05 83.31 Favored 'General case' 0 C--N 1.355 0.81 0 N-CA-C 109.222 -0.658 . . . . 73.44 109.222 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 10.8 mmt180 -63.77 -44.1 94.42 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.558 -0.534 . . . . 75.22 109.558 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.93 74.59 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.716 0.806 . . . . 73.32 111.862 -176.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.46 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -76.47 -61.65 1.89 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 109.842 -0.429 . . . . 75.43 109.842 178.926 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . 0.409 HE21 HD21 ' A' ' 89' ' ' LEU . 86.7 mm-40 -68.82 -33.04 73.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.62 0.768 . . . . 74.42 111.173 -170.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.9 ttm -117.18 80.28 1.46 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.537 -1.282 . . . . 73.02 107.537 171.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 26.1 tp . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 122.115 0.96 . . . . 74.24 108.479 176.895 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 110.583 -0.154 . . . . 61.4 110.583 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.538 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 59.9 m-20 -56.38 -53.86 52.39 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 124.059 0.85 . . . . 74.03 110.784 175.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.7 mt -56.57 -46.36 80.82 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.999 0.812 . . . . 74.03 111.804 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -54.79 -47.61 73.77 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.618 0.574 . . . . 74.11 110.707 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -69.46 -42.17 75.24 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 118.826 -0.607 . . . . 75.35 112.415 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.08 -43.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 123.829 0.852 . . . . 75.02 110.514 -177.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 29.5 mm -67.69 -42.84 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.029 -0.987 . . . . 73.31 110.471 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.2 m -60.68 -48.98 79.34 Favored 'General case' 0 C--N 1.357 0.91 0 O-C-N 123.523 0.515 . . . . 61.33 110.539 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -55.12 -49.97 70.42 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 123.995 0.918 . . . . 75.54 110.119 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.96 -48.45 79.01 Favored Glycine 0 C--N 1.343 0.92 0 O-C-N 124.844 1.34 . . . . 74.24 112.973 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.1 mt-30 -62.44 -49.38 75.68 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.799 0.44 . . . . 73.5 111.284 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.9 -34.92 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.891 0.877 . . . . 71.21 110.764 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.459 HD13 ' O ' ' A' ' 69' ' ' LEU . 8.6 mt -62.92 -48.27 88.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.824 1.25 . . . . 75.34 110.505 177.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -62.76 -36.58 83.51 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 123.994 0.809 . . . . 74.34 110.355 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.8 mmmt -66.24 -48.17 71.4 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.669 0.605 . . . . 75.52 112.083 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -77.66 -17.99 57.16 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.346 0.258 . . . . 75.12 111.646 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.442 ' SG ' HD21 ' A' ' 31' ' ' LEU . 53.0 t -71.33 -22.24 61.94 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.58 0.752 . . . . 71.44 111.031 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.48 -16.69 64.31 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.722 0.409 . . . . 73.43 111.3 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -68.62 -17.18 64.06 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.124 0.57 . . . . 74.32 112.325 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.496 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 5.7 mmt -76.74 83.29 3.35 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.596 -0.52 . . . . 72.22 109.596 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -40.97 72.75 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.703 -1.221 . . . . 73.43 107.703 174.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -92.77 154.53 18.23 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.239 -1.346 . . . . 73.32 108.543 170.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 80.9 m 58.97 58.83 3.02 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.977 0.894 . . . . 71.22 109.344 -171.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -73.36 -34.39 65.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 114.199 -1.364 . . . . 71.52 111.472 -169.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HB3' ' HZ2' ' A' ' 26' ' ' LYS . 5.0 mtpm? -81.74 -27.66 33.72 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.047 -0.723 . . . . 52.21 109.047 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.664 ' HG3' ' HG ' ' A' ' 97' ' ' LEU . 27.4 mm-40 -61.28 -40.65 94.92 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.423 0.689 . . . . 65.12 110.537 165.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 42.5 t -65.55 -36.17 83.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.692 0.797 . . . . 60.2 110.982 176.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -71.97 -31.95 66.78 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.207 0.603 . . . . 75.12 110.92 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 136' ' ' GLU . 21.5 mmt180 -69.14 -52.33 29.22 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.782 0.433 . . . . 73.31 110.373 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.442 HD21 ' SG ' ' A' ' 18' ' ' CYS . 29.7 tp -65.3 -38.85 91.49 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.62 0.575 . . . . 71.53 110.243 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.87 -54.41 38.2 Favored Glycine 0 C--N 1.346 1.111 0 O-C-N 123.691 0.619 . . . . 74.31 112.915 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -64.6 -44.37 90.83 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.848 0.859 . . . . 73.44 110.781 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.487 ' HG2' ' CE2' ' A' ' 133' ' ' TRP . 39.5 mtm180 -57.78 -60.6 3.45 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.084 0.865 . . . . 74.01 110.406 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.09 -51.58 69.08 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.576 0 O-C-N 124.311 1.007 . . . . 75.0 112.1 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.6 -45.65 93.21 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 118.064 0.393 . . . . 74.42 111.01 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -73.18 -18.36 79.19 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.943 -0.571 . . . . 72.34 113.448 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 12.6 tp -87.35 -40.01 14.82 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.52 0.728 . . . . 75.42 111.124 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.415 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 11.8 pt -79.73 -34.56 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 119.058 -0.496 . . . . 74.33 110.361 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -53.68 -50.64 82.34 Favored Pre-proline 0 CA--C 1.562 1.414 0 CA-C-O 117.929 -1.034 . . . . 75.02 113.415 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.636 ' HA ' ' HE2' ' A' ' 44' ' ' MET . 19.3 Cg_endo -58.64 -39.84 78.96 Favored 'Trans proline' 0 C--N 1.4 3.265 0 C-N-CA 121.699 1.6 . . . . 74.44 112.265 177.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.654 HD13 HD22 ' A' ' 45' ' ' LEU . 4.0 mm? -69.48 -31.99 70.61 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.62 -0.718 . . . . 72.45 111.072 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 52.6 mt-10 -70.31 -38.9 75.05 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.065 0.546 . . . . 73.23 111.153 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.636 ' HE2' ' HA ' ' A' ' 41' ' ' PRO . 66.0 mtm -61.77 -46.13 90.92 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 123.625 0.578 . . . . 73.4 111.47 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.654 HD22 HD13 ' A' ' 42' ' ' LEU . 3.7 pp -75.25 -33.06 61.25 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 116.323 -0.399 . . . . 75.23 111.007 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.7 -32.95 74.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.148 0.579 . . . . 74.22 110.572 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 . . . . . 0 N--CA 1.473 0.692 0 C-N-CA 123.936 0.894 . . . . 74.41 111.902 -179.022 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.515 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 28.9 m . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 119.865 -0.112 . . . . 74.1 111.033 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -61.07 -45.28 95.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.128 0.571 . . . . 72.34 111.111 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -59.08 -41.38 87.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.088 0.555 . . . . 75.4 110.878 176.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 55' ' ' SER . 12.2 tp -65.53 -48.77 71.34 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.641 -1.163 . . . . 74.14 110.151 -172.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.2 m -67.28 -39.27 86.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 114.915 -1.039 . . . . 74.53 111.05 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.9 m -65.62 -36.9 85.05 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.145 0.578 . . . . 64.14 111.256 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.28 -45.51 84.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.186 0.595 . . . . 74.21 109.774 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.538 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.8 mmt -68.71 -20.87 64.42 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.034 -0.985 . . . . 72.41 112.327 176.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -74.62 -42.86 57.85 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.242 0.617 . . . . 74.42 109.905 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.15 -41.5 98.34 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.287 0.635 . . . . 74.3 109.827 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.406 ' O ' HD21 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -64.9 -50.99 64.34 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.396 -1.274 . . . . 74.31 109.75 -177.023 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -53.62 -49.37 67.99 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.311 1.044 . . . . 73.2 110.357 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.76 80.11 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.315 1.009 . . . . 75.0 111.773 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.479 ' HB3' HD11 ' A' ' 105' ' ' LEU . . . -66.59 -43.04 85.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.303 0.641 . . . . 61.42 110.862 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.459 ' O ' HD13 ' A' ' 14' ' ' ILE . 4.2 mm? -70.36 -25.82 63.44 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.365 0.666 . . . . 75.35 111.559 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -65.25 -50.45 65.73 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.078 0.466 . . . . 64.21 109.949 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -64.61 -38.96 92.8 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 114.96 -1.018 . . . . 65.54 110.746 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.72 -47.33 85.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.082 0.553 . . . . 70.53 110.904 176.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.67 -38.46 81.55 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.155 0.91 . . . . 73.31 110.814 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.36 -42.04 75.79 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 123.962 0.789 . . . . 63.33 113.118 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.08 -41.59 94.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 122.605 0.362 . . . . 72.23 111.073 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.531 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 4.3 pt -80.76 -18.5 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.502 0.556 . . . . 63.52 112.502 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -64.68 -33.69 76.54 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.127 -0.694 . . . . 74.12 109.127 165.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -76.75 -39.53 51.44 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.754 -0.657 . . . . 74.05 110.894 173.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.531 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.4 m-30 -74.11 -12.4 60.59 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 112.867 0.692 . . . . 72.42 112.867 -177.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.2 p -61.0 -31.12 70.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.024 0.44 . . . . 70.13 110.276 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -89.65 115.87 27.35 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.179 -1.045 . . . . 74.5 108.179 167.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -74.35 -25.13 59.34 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.784 0.834 . . . . 73.31 110.992 -172.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -68.71 -34.45 75.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.628 0.771 . . . . 73.3 110.31 174.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.9 -35.54 74.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.398 0.679 . . . . 72.22 110.359 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.453 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.5 mt -58.65 -58.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 N-CA-C 108.827 -0.805 . . . . 75.2 108.827 171.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.0 t -53.0 -37.98 61.92 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.005 0.922 . . . . 70.53 111.825 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -62.6 -52.26 64.07 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-N 115.123 -0.944 . . . . 75.04 111.266 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -28.94 64.41 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.146 -0.316 . . . . 75.33 110.146 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.52 HD13 ' HG2' ' A' ' 145' ' ' ARG . 11.5 tp -74.81 -39.36 61.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.695 1.198 . . . . 72.42 111.524 -166.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -67.22 -22.94 65.69 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.235 -0.893 . . . . 72.13 110.661 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.3 -10.2 17.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.509 0.724 . . . . 64.13 112.149 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 92.2 p . . . . . 0 N--CA 1.476 0.864 0 C-N-CA 122.682 0.393 . . . . 73.14 110.139 179.617 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.5 mp . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 108.593 -0.892 . . . . 74.41 108.593 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.664 ' HG ' ' HG3' ' A' ' 27' ' ' GLN . 15.5 mt -65.19 -38.98 92.2 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 122.173 0.987 . . . . 75.44 110.093 177.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.412 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 56.7 m-85 -107.07 43.86 1.12 Allowed 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 113.715 -1.584 . . . . 73.34 109.445 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -63.46 -64.81 0.8 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.357 -0.979 . . . . 73.55 108.357 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.74 -42.82 85.65 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.785 -1.098 . . . . 74.34 110.302 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.476 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 50.0 t -59.65 -54.74 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 124.149 0.906 . . . . 73.13 111.278 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.07 -25.82 61.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 119.186 -0.435 . . . . 74.24 110.727 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -61.0 -43.93 98.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 109.815 -0.439 . . . . 75.34 109.815 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.476 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 42.5 mttm -60.36 -57.45 12.72 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.902 0.881 . . . . 73.34 110.744 175.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.479 HD11 ' HB3' ' A' ' 68' ' ' ALA . 10.2 mp -54.6 -41.0 69.43 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.9 0.75 . . . . 75.12 111.348 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.2 t -71.64 -42.11 67.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.346 0.658 . . . . 61.31 111.264 -176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.733 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 17.7 t70 -71.93 -44.96 62.77 Favored 'General case' 0 C--O 1.254 1.305 0 O-C-N 123.623 0.577 . . . . 63.1 110.718 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.7 t -58.57 -49.74 81.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 CA-C-N 115.003 -0.999 . . . . 74.33 109.173 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -64.16 -29.07 70.21 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.011 0.819 . . . . 73.22 111.83 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.733 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 40.8 mtpt -56.69 -67.69 0.29 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 108.54 -0.911 . . . . 72.43 108.54 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.16 -29.84 71.11 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 124.084 0.865 . . . . 71.44 111.902 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.497 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.3 tt -72.52 -50.21 27.38 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.622 0.769 . . . . 75.54 110.142 -175.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.4 p -62.08 -37.6 85.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.446 0.298 . . . . 74.31 110.689 177.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 94.1 mt -60.11 -44.62 94.72 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.372 -0.831 . . . . 74.52 111.701 176.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -78.49 -21.8 48.43 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 112.23 0.456 . . . . 75.34 112.23 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 84.7 mt -63.97 -43.19 96.53 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.918 -0.771 . . . . 75.25 108.918 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.69 -47.47 66.34 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.698 0.799 . . . . 72.32 112.269 175.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.2 t -64.19 -60.65 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.23 0.612 . . . . 73.32 111.372 -177.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -86.32 -54.47 4.42 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.797 -0.638 . . . . 75.13 111.37 -168.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -88.37 -6.27 57.81 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.503 0.557 . . . . 75.01 112.503 -175.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 52.7 ttt85 66.16 7.57 4.91 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.854 1.262 . . . . 72.33 112.771 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 37.1 mtp -65.46 118.34 49.63 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.258 1.023 . . . . 65.52 111.423 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 C--N 1.377 2.051 0 C-N-CA 123.612 2.874 . . . . 71.14 112.559 -176.647 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.487 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 37.3 m0 . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 113.141 0.793 . . . . 74.12 113.141 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.46 -27.97 69.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.749 0.42 . . . . 64.14 111.612 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -88.81 -46.6 8.83 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.636 0.774 . . . . 75.33 110.705 174.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 49.8 mt-10 -64.11 -62.56 1.55 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.152 0.981 . . . . 72.22 111.6 -174.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -53.84 -34.07 58.18 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.871 0.869 . . . . 72.34 111.895 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -67.13 -52.04 46.56 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.109 0.564 . . . . 73.24 112.216 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.74 -48.69 80.67 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.556 0.535 . . . . 74.4 109.902 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.47 -38.31 86.8 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 114.248 -1.342 . . . . 64.23 110.313 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.0 97.6 Favored 'General case' 0 C--O 1.22 -0.46 0 O-C-N 124.121 0.888 . . . . 73.14 112.374 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.33 -47.78 84.36 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 109.181 -0.674 . . . . 74.35 109.181 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.93 -48.25 82.13 Favored 'General case' 0 CA--C 1.555 1.141 0 O-C-N 124.389 1.055 . . . . 74.11 111.35 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -70.33 -56.11 7.51 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.079 0.952 . . . . 75.14 112.378 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.52 ' HG2' HD13 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -62.11 -43.07 99.65 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.318 1.047 . . . . 72.32 109.738 -173.696 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -63.45 -49.76 72.4 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 123.971 0.794 . . . . 75.43 109.632 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.73 70.71 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 112.312 0.486 . . . . 72.11 112.312 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -45.62 60.27 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.31 0.644 . . . . 70.42 109.555 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -76.51 -13.25 60.11 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 115.754 -0.657 . . . . 75.13 112.096 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 48.8 mtm -97.57 -77.59 0.5 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.084 -0.709 . . . . 74.41 109.084 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 N--CA 1.488 1.429 0 C-N-CA 124.907 1.283 . . . . 71.45 111.663 -172.375 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 119.642 -0.218 . . . . 75.32 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -55.42 -45.05 76.75 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.857 0.863 . . . . 72.1 110.535 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.12 -41.53 94.77 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.364 -0.834 . . . . 73.3 110.69 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -57.19 -43.4 82.63 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.746 0.654 . . . . 75.53 110.862 177.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -60.71 -55.71 29.95 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.619 0.574 . . . . 72.32 110.584 178.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.26 -49.39 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.817 0.847 . . . . 73.33 111.761 -177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 80.5 mt -71.12 -43.59 75.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.708 1.203 . . . . 73.41 111.197 -172.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' HG23 ' A' ' 13' ' ' VAL . 97.5 m -63.45 -48.88 75.89 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.697 0.399 . . . . 72.41 110.536 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.1 mt -53.71 -50.36 66.07 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.05 0.843 . . . . 75.34 110.471 177.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.69 -52.31 46.56 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 124.602 1.189 . . . . 75.11 112.996 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.69 -48.24 82.45 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.773 0.429 . . . . 64.24 111.463 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 9' ' ' THR . 46.5 t -68.34 -25.24 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.086 0.554 . . . . 73.41 111.061 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.464 HD11 ' O ' ' A' ' 69' ' ' LEU . 33.4 mt -64.43 -48.4 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.83 0.852 . . . . 71.33 109.181 172.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.411 ' HB2' HG11 ' A' ' 35' ' ' VAL . 38.9 t-80 -59.37 -37.71 78.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.404 0.681 . . . . 74.03 111.134 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -63.75 -59.02 5.1 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.804 0.69 . . . . 74.23 110.966 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -74.69 -16.82 60.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.063 0.545 . . . . 75.31 111.755 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.63 -23.22 65.32 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.365 0.666 . . . . 73.11 111.289 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.96 -8.52 53.7 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.165 0.586 . . . . 73.33 111.653 178.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.85 -23.27 67.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.597 0.359 . . . . 63.01 111.153 170.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.432 ' HE3' HG23 ' A' ' 76' ' ' ILE . 7.2 mmt -74.88 87.44 2.28 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.697 -0.853 . . . . 72.3 108.697 176.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -36.09 75.13 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 107.359 -1.348 . . . . 72.53 107.359 168.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -89.72 175.91 7.06 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.622 -1.172 . . . . 74.21 108.454 171.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.61 ' SG ' HG23 ' A' ' 85' ' ' ILE . 99.9 m 57.79 74.03 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.796 0.685 . . . . 61.23 110.405 -172.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.76 -60.44 3.09 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.731 1.212 . . . . 74.13 110.585 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 57.5 mmtt -63.67 -49.46 73.07 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 115.145 -0.934 . . . . 75.24 110.381 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 14.0 mt-30 -60.55 -34.91 74.83 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.1 0.56 . . . . 75.23 112.243 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.4 t -74.21 -44.43 53.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.619 0.368 . . . . 72.14 110.948 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -65.79 -38.82 90.05 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 122.713 0.405 . . . . 75.11 110.911 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.508 ' NH2' ' HA ' ' A' ' 137' ' ' ASP . 18.2 mtp180 -67.9 -38.47 83.01 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.123 0.969 . . . . 64.03 110.627 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER -60.05 -50.81 72.24 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.995 0.81 . . . . 75.13 108.91 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -40.2 97.31 Favored Glycine 0 C--N 1.348 1.211 0 O-C-N 123.971 0.795 . . . . 71.12 113.202 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -57.0 -47.76 80.05 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.35 1.06 . . . . 74.43 110.71 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.5 mtt-85 -64.68 -48.78 73.47 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 114.726 -1.124 . . . . 73.41 110.753 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.411 HG11 ' HB2' ' A' ' 15' ' ' HIS . 41.7 t -54.09 -61.62 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.518 0 O-C-N 124.148 0.905 . . . . 73.15 111.185 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.481 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 72.2 mt -65.39 -46.42 80.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.074 0.859 . . . . 70.22 110.564 -172.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -37.78 76.97 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 116.058 -0.519 . . . . 74.3 113.069 176.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.467 HD22 ' HE1' ' A' ' 65' ' ' PHE . 18.0 tp -84.33 -38.13 20.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.853 0.861 . . . . 73.45 112.471 -173.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.433 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 16.3 pt -75.46 -37.45 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 119.42 -0.324 . . . . 74.2 110.871 -176.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.481 ' HD3' ' O ' ' A' ' 36' ' ' LEU . 5.6 mptp? -51.7 -51.81 66.59 Favored Pre-proline 0 N--CA 1.485 1.296 0 N-CA-C 114.021 1.119 . . . . 75.11 114.021 -174.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 19.6 Cg_endo -55.43 -37.52 94.74 Favored 'Trans proline' 0 C--N 1.395 3.007 0 C-N-CA 122.357 2.038 . . . . 73.21 112.669 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 -40.77 76.19 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.377 0.671 . . . . 72.33 110.658 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 92.7 mt-10 -66.74 -37.13 84.04 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.405 1.082 . . . . 74.42 111.299 -179.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 34.6 mmt -65.76 -40.15 91.77 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.728 0.642 . . . . 71.55 110.431 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -76.82 -38.26 54.18 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.281 -0.418 . . . . 72.03 110.403 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -39.2 87.65 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.485 0.714 . . . . 74.25 111.67 -178.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 . . . . . 0 N--CA 1.473 0.709 0 C-N-CA 123.866 0.866 . . . . 73.02 110.899 -178.196 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 109.684 -0.487 . . . . 74.3 109.684 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -59.98 -38.29 82.12 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.958 0.503 . . . . 74.52 110.735 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HG3' HD21 ' A' ' 58' ' ' LEU . 61.8 pttt -62.42 -37.27 85.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.371 0.668 . . . . 71.5 111.626 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.622 HD13 HD12 ' A' ' 115' ' ' LEU . 4.0 mm? -65.96 -51.12 61.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.674 0.39 . . . . 74.1 110.172 175.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.5 m -58.67 -45.42 89.42 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.11 0.881 . . . . 71.42 111.229 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 51.0 m -59.73 -44.89 93.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.875 0.87 . . . . 74.32 110.212 176.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.67 -44.44 96.47 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.706 0.629 . . . . 75.41 111.494 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.401 ' HE1' ' HA ' ' A' ' 62' ' ' MET . 4.6 mmt -67.45 -31.47 71.66 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.82 0.848 . . . . 62.5 111.141 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -74.29 -44.9 50.78 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.677 0.791 . . . . 73.22 111.057 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -61.25 -44.2 97.63 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.768 0.827 . . . . 73.14 109.727 175.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.467 ' HE1' HD22 ' A' ' 38' ' ' LEU . 3.4 t80 -59.62 -58.13 9.93 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 113.533 -1.667 . . . . 63.23 109.958 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.9 ttpp -52.71 -45.53 66.93 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 124.6 1.187 . . . . 73.2 110.913 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.82 79.03 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 124.311 1.007 . . . . 70.53 111.785 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.15 -34.8 71.34 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.339 0.656 . . . . 72.01 111.737 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.464 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -63.84 -40.12 95.84 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 122.554 0.342 . . . . 64.24 110.737 170.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 37.5 mt-10 -63.4 -42.07 98.77 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.151 0.58 . . . . 73.05 110.413 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 39.1 mt-10 -58.26 -54.65 44.65 Favored 'General case' 0 C--N 1.355 0.837 0 CA-C-N 114.907 -1.042 . . . . 74.11 110.124 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.19 -43.67 78.67 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.569 1.168 . . . . 74.41 111.884 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.06 -51.64 68.48 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 124.68 1.237 . . . . 75.15 109.854 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.04 -31.31 80.48 Favored Glycine 0 CA--C 1.535 1.282 0 CA-C-N 115.036 -0.984 . . . . 71.21 114.171 178.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 29.8 mm-40 -67.65 -56.42 9.45 Favored 'General case' 0 C--N 1.356 0.879 0 CA-C-N 116.947 0.373 . . . . 74.35 110.396 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.531 HG22 ' CZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -59.29 -28.26 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.937 -0.477 . . . . 74.43 111.43 175.557 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.07 -46.52 89.31 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.037 0.384 . . . . 74.23 112.037 171.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 14.1 ptpt -73.77 -25.29 60.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 117.852 0.296 . . . . 73.32 110.87 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.58 -2.41 57.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.541 0.736 . . . . 74.35 112.851 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.9 p -57.13 -31.14 65.02 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.978 0.511 . . . . 74.44 111.189 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -83.83 115.51 22.28 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 107.913 -1.143 . . . . 63.52 107.913 165.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -74.3 -23.02 59.03 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.482 0.713 . . . . 64.0 111.083 -172.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.8 p -59.82 -32.34 70.56 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.071 0.948 . . . . 71.53 111.765 171.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -63.17 -42.28 99.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.423 0.689 . . . . 71.44 110.327 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.61 HG23 ' SG ' ' A' ' 24' ' ' CYS . 52.5 mt -59.63 -58.7 5.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 114.812 -1.086 . . . . 71.14 109.44 178.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.0 t -56.5 -35.6 68.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.153 0.581 . . . . 74.32 111.693 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -57.38 -58.32 8.78 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.426 1.09 . . . . 74.1 111.621 178.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.402 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 1.7 p90 -75.47 -34.7 60.93 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.779 -0.452 . . . . 72.44 109.779 -177.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.509 HD22 HE22 ' A' ' 149' ' ' GLN . 12.7 tp -66.32 -37.94 86.52 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.65 1.18 . . . . 75.25 111.503 -168.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -66.67 -19.43 65.76 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.86 -0.609 . . . . 74.5 111.221 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.94 -23.0 14.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.101 0.96 . . . . 70.45 111.423 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 74.4 m . . . . . 0 N--CA 1.479 0.979 0 C-N-CA 124.368 1.067 . . . . 72.11 110.721 -174.308 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.536 HD12 ' HB2' ' A' ' 141' ' ' ALA . 14.1 mm . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 108.826 -0.805 . . . . 72.4 108.826 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.402 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 2.0 tp -50.54 -43.71 56.2 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.632 0.729 . . . . 75.34 111.582 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.531 ' CZ ' HG22 ' A' ' 76' ' ' ILE . 3.5 m-85 -118.05 25.09 10.58 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 114.421 -1.263 . . . . 71.03 110.797 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -40.34 -56.95 1.87 Allowed 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 124.535 1.134 . . . . 75.51 112.559 -167.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.96 -55.32 8.59 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.184 0.993 . . . . 74.31 111.074 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.4 -46.1 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 124.29 1.036 . . . . 71.11 111.954 -174.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -76.38 -28.73 56.87 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.983 1.313 . . . . 73.22 110.407 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -62.48 -39.4 93.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 109.85 -0.426 . . . . 73.22 109.85 168.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.446 ' HZ3' ' HB3' ' A' ' 104' ' ' LYS . 8.4 mtpm? -68.39 -36.94 79.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.38 0.672 . . . . 75.25 110.464 175.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.84 -39.15 90.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.854 0.461 . . . . 72.01 110.777 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 66.1 m -72.6 -41.06 66.02 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.368 0.667 . . . . 71.13 111.209 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.491 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 15.9 t70 -80.1 -36.3 35.63 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.748 0.419 . . . . 75.21 110.599 -176.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.473 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.2 t -69.85 -28.78 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 110.084 -0.339 . . . . 75.45 110.084 172.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -69.43 -34.84 75.03 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 119.333 -0.365 . . . . 70.52 110.703 170.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.491 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 51.8 mtpt -57.22 -57.61 11.85 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 109.616 -0.513 . . . . 75.35 109.616 171.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.2 mt-10 -51.72 -47.18 64.09 Favored 'General case' 0 C--N 1.358 0.94 0 O-C-N 124.447 1.092 . . . . 72.55 110.415 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -64.08 -60.46 3.21 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 124.176 0.99 . . . . 74.12 109.965 -173.057 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -53.27 -38.94 63.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.065 0.946 . . . . 63.52 111.513 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.429 ' O ' HG21 ' A' ' 118' ' ' VAL . 96.6 mt -60.2 -62.78 1.61 Allowed 'General case' 0 CA--C 1.545 0.777 0 O-C-N 123.703 0.627 . . . . 75.14 111.149 175.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.622 HD12 HD13 ' A' ' 58' ' ' LEU . 2.5 pp -65.9 -23.15 66.58 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.724 0.639 . . . . 72.23 112.724 -176.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.418 HD12 ' SD ' ' A' ' 122' ' ' MET . 80.8 mt -72.86 -42.28 63.84 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 123.483 0.713 . . . . 74.52 110.001 175.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -75.77 -26.01 56.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.506 0.322 . . . . 74.22 111.402 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 114' ' ' LEU . 77.8 t -75.25 -61.81 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.695 -0.483 . . . . 74.3 109.695 177.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -59.02 2.37 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.977 0.511 . . . . 75.31 110.066 -170.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.407 ' OE1' ' HA ' ' A' ' 116' ' ' LEU . 27.8 mp0 -76.85 -14.09 59.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.241 0.616 . . . . 74.4 111.569 -174.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 63.65 22.84 13.3 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 124.884 1.274 . . . . 75.44 111.04 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.528 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 48.6 ttm -55.45 115.41 9.24 Favored Pre-proline 0 C--N 1.357 0.894 0 C-N-CA 124.654 1.182 . . . . 71.54 111.999 -173.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--N 1.367 1.502 0 C-N-CA 122.108 1.872 . . . . 75.21 109.72 172.566 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 11.3 m0 . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 113.286 0.847 . . . . 75.31 113.286 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.52 -40.76 18.76 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.781 -0.574 . . . . 73.44 110.721 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -73.35 -39.05 65.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.989 -1.005 . . . . 74.35 111.481 -171.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 140' ' ' ASP . 41.7 mt-10 -52.59 -56.82 12.63 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 124.917 1.287 . . . . 75.14 111.068 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.508 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 3.5 m-20 -63.5 -57.64 9.57 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.031 -0.986 . . . . 74.1 112.368 -172.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -59.23 -58.89 6.66 Favored 'General case' 0 CA--C 1.561 1.404 0 O-C-N 123.062 0.226 . . . . 75.51 111.406 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.82 -56.19 6.87 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 122.36 0.264 . . . . 74.2 110.63 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 136' ' ' GLU . 5.5 m-20 -74.99 -28.84 60.7 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.299 -0.858 . . . . 71.43 112.254 -170.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.536 ' HB2' HD12 ' A' ' 96' ' ' ILE . . . -78.89 -24.44 44.2 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.655 1.116 . . . . 74.13 110.967 176.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -65.84 -47.03 76.37 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 109.745 -0.465 . . . . 75.14 109.745 167.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.69 -39.66 77.66 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.952 0.901 . . . . 74.32 110.781 175.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.588 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 29.8 t0 -75.02 -42.93 56.32 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.198 0.999 . . . . 71.1 111.906 -172.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 61.6 ttt-85 -64.7 -41.7 95.83 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.1 -0.954 . . . . 71.14 109.719 178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -65.09 -34.9 79.51 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.186 -0.915 . . . . 74.43 110.806 172.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.56 -19.56 59.22 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.855 0.462 . . . . 73.52 111.491 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.63 -58.79 3.06 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.866 -0.79 . . . . 64.21 108.866 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . 0.509 HE22 HD22 ' A' ' 89' ' ' LEU . 1.9 mp0 -70.14 -46.72 64.13 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.587 0.755 . . . . 75.42 111.494 -175.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 75.3 mtp -96.86 36.25 1.43 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.572 0.749 . . . . 74.33 110.397 -178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 50.5 tp . . . . . 0 CA--C 1.547 0.832 0 C-N-CA 123.703 0.801 . . . . 75.53 110.702 -179.701 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.553 -0.166 . . . . 75.14 110.553 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -61.07 -41.01 95.83 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.885 0.74 . . . . 71.54 109.484 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.428 HD13 HD11 ' A' ' 42' ' ' LEU . 3.6 mm? -58.17 -52.11 66.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.303 0.641 . . . . 75.34 110.409 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -53.85 -38.67 64.91 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.135 0.574 . . . . 73.34 111.083 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.424 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.5 t-80 -65.88 -49.5 67.85 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 123.805 0.691 . . . . 75.3 110.49 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.96 -52.58 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 124.876 1.27 . . . . 74.03 111.477 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.71 -40.87 90.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.035 0.934 . . . . 70.34 110.693 -177.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 55.3 m -62.75 -42.5 99.71 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.693 0.397 . . . . 75.34 110.75 176.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 79.6 mt -57.4 -56.65 19.09 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.37 0.419 . . . . 72.14 110.084 177.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.58 -35.7 92.18 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 124.279 0.987 . . . . 72.31 113.827 -176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 4.5 tp-100 -70.38 -49.5 48.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 109.636 -0.505 . . . . 74.13 109.636 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.99 -33.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.564 0.746 . . . . 72.02 110.774 175.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.1 mt -54.61 -55.96 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.949 0.9 . . . . 65.15 109.768 173.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -60.39 -38.7 84.79 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 124.155 0.909 . . . . 73.2 111.686 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 13.5 mptt -60.84 -54.64 42.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.008 0.923 . . . . 72.32 111.918 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -79.48 -19.22 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.461 0.704 . . . . 65.31 111.989 -175.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.6 t -64.33 -17.81 64.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.365 1.066 . . . . 75.41 113.068 177.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -55.42 -20.63 12.82 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 123.961 0.905 . . . . 72.31 112.915 175.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -62.8 -29.87 71.04 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.408 0.683 . . . . 73.31 112.472 175.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.433 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 8.3 mmt -78.45 81.83 4.76 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.101 0.477 . . . . 65.04 110.679 -173.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -80.55 -34.51 35.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.139 -1.06 . . . . 75.21 108.139 169.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.441 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 85.7 m-85 -90.81 153.32 20.32 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 114.186 -1.37 . . . . 71.52 108.217 170.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m 57.81 70.99 0.61 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.369 1.08 . . . . 53.53 109.536 -166.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.416 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 0.1 OUTLIER -75.08 -48.69 22.65 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 113.803 -1.544 . . . . 73.55 109.411 -170.559 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.0 mptp? -61.68 -37.37 83.84 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 109.416 -0.587 . . . . 75.21 109.416 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.763 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 16.0 mm-40 -66.25 -43.85 85.37 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 117.862 0.301 . . . . 70.11 111.16 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 52.7 t -66.78 -43.02 85.08 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.906 0.882 . . . . 73.12 111.874 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.3 mpt_? -80.93 -33.55 33.97 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.557 0.743 . . . . 74.4 111.033 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.504 ' NH2' ' HB2' ' A' ' 136' ' ' GLU . 25.6 tpt180 -73.16 -38.63 66.15 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.185 -0.672 . . . . 64.33 109.185 176.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.73 -46.33 90.11 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 123.815 0.697 . . . . 74.12 109.159 173.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.2 -46.22 93.07 Favored Glycine 0 C--N 1.349 1.298 0 O-C-N 123.879 0.737 . . . . 71.12 112.63 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -60.46 -52.82 63.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.453 0.701 . . . . 74.54 110.452 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.52 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 16.3 mtt180 -58.81 -63.4 1.31 Allowed 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.094 0.871 . . . . 73.21 110.547 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.423 ' O ' HG12 ' A' ' 39' ' ' ILE . 55.8 t -50.93 -50.57 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.305 1.042 . . . . 73.04 111.942 -175.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -62.46 -41.54 98.83 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 123.369 0.418 . . . . 71.25 111.188 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.55 -23.55 72.12 Favored Glycine 0 N--CA 1.474 1.17 0 CA-C-N 116.325 -0.398 . . . . 61.5 113.34 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.559 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 27.6 mt -87.2 -46.98 9.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 74.32 111.301 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 35' ' ' VAL . 23.0 pt -80.47 -41.55 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 117.933 -1.032 . . . . 70.41 111.917 -170.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -54.77 -48.27 95.97 Favored Pre-proline 0 N--CA 1.497 1.891 0 N-CA-C 113.724 1.009 . . . . 75.43 113.724 -174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.66 ' HA ' ' HE2' ' A' ' 44' ' ' MET . 55.9 Cg_exo -54.76 -39.36 89.94 Favored 'Trans proline' 0 C--N 1.391 2.785 0 C-N-CA 122.1 1.866 . . . . 74.23 112.868 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.481 HD13 HD22 ' A' ' 45' ' ' LEU . 4.2 mm? -77.08 -29.39 54.97 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.224 -0.898 . . . . 75.21 111.359 178.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -67.22 -38.14 84.76 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.323 0.649 . . . . 72.2 109.973 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.66 ' HE2' ' HA ' ' A' ' 41' ' ' PRO . 67.3 mtm -62.07 -50.77 70.65 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.779 0.675 . . . . 75.02 111.019 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.481 HD22 HD13 ' A' ' 42' ' ' LEU . 4.4 pp -76.51 -22.77 54.0 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.698 0.399 . . . . 65.33 111.967 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -71.24 -41.15 70.51 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.608 0.763 . . . . 72.45 110.211 174.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.481 1.077 0 C-N-CA 123.909 0.884 . . . . 75.42 108.882 -177.912 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 N--CA 1.468 0.439 0 N-CA-C 108.12 -1.066 . . . . 61.33 108.12 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -62.74 -44.73 95.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 122.495 0.318 . . . . 74.44 110.875 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.535 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.86 -37.28 76.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.388 0.675 . . . . 64.41 111.147 175.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.45 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 2.8 tm? -70.94 -47.66 57.77 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 124.11 0.964 . . . . 73.45 109.392 -175.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.3 m -64.46 -40.57 95.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.08 0.862 . . . . 74.41 110.857 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.8 m -58.52 -49.11 78.58 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.788 0.835 . . . . 73.15 110.756 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.09 98.64 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.722 0.809 . . . . 73.44 111.0 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.501 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.6 mmt -67.84 -33.62 75.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.668 0.787 . . . . 74.44 111.14 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -73.27 -35.88 66.26 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.544 0.737 . . . . 64.35 110.751 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.278 0.631 . . . . 61.43 110.112 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.559 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 2.5 t80 -67.17 -45.91 75.56 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.116 1.366 . . . . 70.11 109.507 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.2 ttpp -58.32 -51.29 70.4 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.812 -1.54 . . . . 73.22 110.009 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.72 -43.2 76.3 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.177 0.923 . . . . 75.11 111.392 -178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.504 ' HB3' HD12 ' A' ' 105' ' ' LEU . . . -61.8 -42.63 99.26 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 114.984 -1.007 . . . . 74.51 111.639 177.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -74.41 -25.8 59.68 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.931 0.492 . . . . 73.33 112.3 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 62.1 mt-10 -67.11 -44.04 80.95 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.619 0.724 . . . . 73.35 109.341 174.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.1 mt-10 -67.53 -43.18 81.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.509 -1.223 . . . . 75.54 111.01 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.57 -40.26 96.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.466 0.707 . . . . 62.2 111.23 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.42 -43.43 98.88 Favored 'General case' 0 C--N 1.351 0.64 0 O-C-N 124.235 0.959 . . . . 75.21 109.758 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.2 -33.34 86.98 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.555 -0.748 . . . . 62.34 113.89 175.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 26.0 mm-40 -63.69 -57.94 8.45 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.998 -0.371 . . . . 73.14 109.998 178.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.56 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -66.7 -20.13 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.62 0.6 . . . . 74.3 112.62 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.74 -49.56 75.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.104 -0.702 . . . . 72.23 109.104 171.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -80.83 -25.97 37.36 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 111.811 0.3 . . . . 74.14 111.811 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.56 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.7 m-30 -77.81 -5.21 50.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.595 0.758 . . . . 74.32 112.131 -178.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.8 p -55.91 -30.71 62.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.244 0.617 . . . . 74.42 110.178 173.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -81.76 107.55 14.58 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 108.657 -0.868 . . . . 73.51 108.657 167.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -68.26 -25.82 65.36 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.345 0.658 . . . . 75.54 110.749 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.7 p -71.23 -33.02 69.47 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 75.2 111.336 175.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.95 -40.57 98.08 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.566 0.746 . . . . 65.23 110.047 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.577 HG22 HD11 ' A' ' 97' ' ' LEU . 32.3 mt -57.87 -61.25 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.846 0 CA-C-N 114.83 -1.077 . . . . 73.23 109.911 175.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.99 -40.57 61.15 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.976 0.91 . . . . 72.24 111.971 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 47.3 tpt85 -58.92 -56.68 19.11 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.449 -1.25 . . . . 74.32 111.754 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -21.27 51.66 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 110.219 -0.289 . . . . 72.11 110.219 -177.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.489 HD22 HE22 ' A' ' 149' ' ' GLN . 17.3 tp -73.3 -40.81 64.24 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.932 0.893 . . . . 72.01 110.576 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -67.11 -23.92 65.88 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.026 0.441 . . . . 54.12 110.607 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.33 -0.26 41.5 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.591 1.156 . . . . 72.11 111.8 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.6 t . . . . . 0 N--CA 1.474 0.742 0 C-N-CA 123.279 0.632 . . . . 54.01 110.369 -176.252 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.657 HD12 ' HG2' ' A' ' 99' ' ' LYS . 3.1 mp . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.825 -0.435 . . . . 74.33 109.825 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.763 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.9 tp -62.97 -39.75 95.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.237 1.015 . . . . 74.34 111.096 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -103.56 17.74 23.42 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 114.354 -1.294 . . . . 72.42 111.016 -175.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.657 ' HG2' HD12 ' A' ' 96' ' ' ILE . 2.1 tmtp? -35.45 -64.27 0.3 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 124.78 1.232 . . . . 74.52 113.571 -157.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.446 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 25.8 t70 -61.82 -48.84 78.77 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 124.044 0.84 . . . . 70.34 110.797 -175.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.19 -44.95 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.85 . . . . 74.32 111.268 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -75.43 -25.93 57.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.599 0.76 . . . . 72.12 110.221 -175.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.65 -38.64 89.91 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.827 -0.805 . . . . 74.43 108.827 170.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 100' ' ' ASP . 1.4 mptm? -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 118.855 -0.593 . . . . 72.04 110.846 172.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.504 HD12 ' HB3' ' A' ' 68' ' ' ALA . 10.5 mp -58.12 -43.76 87.38 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 119.275 0.943 . . . . 75.22 110.389 172.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.52 ' HB2' HH12 ' A' ' 34' ' ' ARG . 9.5 t -67.33 -51.62 50.16 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.421 0.688 . . . . 70.52 111.256 -175.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 14.0 t70 -69.26 -50.02 50.81 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.531 -1.213 . . . . 73.02 110.11 -174.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.56 -35.95 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 118.944 -0.55 . . . . 75.03 110.806 -178.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -60.6 -48.52 81.39 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 118.373 0.533 . . . . 75.01 110.567 176.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.42 -37.08 84.41 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 118.931 -0.557 . . . . 75.45 110.961 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.5 mm-40 -61.42 -48.23 82.15 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.265 0.484 . . . . 52.24 111.398 175.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.501 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.0 tt -64.79 -51.93 59.55 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.294 1.438 . . . . 75.42 109.733 -175.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.9 t -60.78 -42.24 97.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.802 1.241 . . . . 71.23 111.538 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.2 -55.88 27.1 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 119.342 -0.361 . . . . 75.21 110.86 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.535 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 4.5 pp -61.53 -29.82 70.24 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.579 0.228 . . . . 71.1 111.571 -177.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.547 HD22 ' SD ' ' A' ' 122' ' ' MET . 58.9 mt -62.42 -53.63 52.01 Favored 'General case' 0 C--N 1.359 0.99 0 CA-C-N 115.813 -0.63 . . . . 71.53 111.126 171.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -68.88 -35.1 76.48 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.979 0.512 . . . . 73.41 111.839 -175.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.61 -58.68 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.183 0.593 . . . . 72.0 110.512 -177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -97.05 -56.42 2.56 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.354 0.502 . . . . 64.34 112.354 -171.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -71.46 -14.87 62.27 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 112.128 0.418 . . . . 73.44 112.128 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 60.53 23.53 13.22 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.842 1.257 . . . . 75.15 111.975 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.547 ' SD ' HD22 ' A' ' 116' ' ' LEU . 64.4 mtp -79.96 118.26 71.52 Favored Pre-proline 0 C--N 1.351 0.666 0 C-N-CA 124.408 1.083 . . . . 75.1 109.552 179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 C--N 1.372 1.81 0 C-N-CA 123.148 2.565 . . . . 71.31 111.882 -177.271 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.449 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 11.0 t90 . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 120.473 0.178 . . . . 65.22 110.888 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.23 -20.63 65.71 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.793 0.837 . . . . 73.44 112.145 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.423 ' O ' ' HG2' ' A' ' 138' ' ' GLN . 67.3 mt-30 -77.68 -34.23 53.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.32 0.648 . . . . 72.24 110.27 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.504 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . 45.2 mt-10 -64.88 -42.19 95.01 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 109.236 -0.653 . . . . 73.44 109.236 173.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -56.52 -44.72 81.07 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.886 0.741 . . . . 74.14 111.836 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 2.5 pt20 -76.17 -30.7 58.19 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.387 0.429 . . . . 65.23 111.58 -176.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -65.63 -53.05 46.88 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.654 0.782 . . . . 74.42 110.253 174.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.8 -46.88 77.91 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 114.534 -1.212 . . . . 71.35 111.221 175.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.407 ' HA ' ' NE2' ' A' ' 27' ' ' GLN . . . -68.2 -29.26 68.07 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.821 0.849 . . . . 53.13 112.808 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.36 -49.62 66.29 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.157 0.503 . . . . 64.21 109.988 175.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.7 -31.69 73.03 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.382 -1.281 . . . . 74.24 111.605 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.7 t0 -79.55 -41.44 27.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.058 0.943 . . . . 71.33 111.509 -175.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.4 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 53.8 ttt180 -66.6 -37.16 84.32 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.731 . . . . 64.24 109.629 176.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -68.7 -35.64 77.45 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.317 -0.856 . . . . 74.42 110.829 171.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -23.96 61.31 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.664 0.386 . . . . 63.14 111.172 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.441 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.3 OUTLIER -79.7 -60.82 2.2 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.31 0.644 . . . . 73.32 110.011 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . 0.489 HE22 HD22 ' A' ' 89' ' ' LEU . 2.0 mp0 -71.03 -45.35 64.06 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.841 0.456 . . . . 73.21 111.186 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ttm -99.88 60.38 1.09 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.016 -1.105 . . . . 60.31 108.016 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 30.9 tp . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.17 0.986 . . . . 72.22 109.311 179.531 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 CA--C 1.552 1.037 0 CA-C-O 119.547 -0.264 . . . . 75.53 111.669 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.21 -45.22 61.82 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.465 0.706 . . . . 73.13 110.314 172.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.416 ' O ' HD11 ' A' ' 8' ' ' ILE . 4.0 mm? -65.06 -41.56 95.01 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 115.153 -0.93 . . . . 74.22 110.675 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -57.82 -46.55 84.54 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 109.605 -0.517 . . . . 74.52 109.605 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -60.79 -55.46 32.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.757 0.66 . . . . 71.12 110.859 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.7 mt -57.42 -53.95 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.724 0.809 . . . . 75.41 112.167 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.482 HD13 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -61.07 -44.34 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.301 1.04 . . . . 75.43 110.511 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 95.9 m -63.73 -46.38 85.64 Favored 'General case' 0 C--N 1.358 0.952 0 C-N-CA 122.88 0.472 . . . . 74.21 111.262 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.8 -46.28 87.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.466 0.706 . . . . 62.32 110.936 -178.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.418 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.2 -49.93 71.1 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 124.608 1.193 . . . . 75.03 111.966 178.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -56.09 -46.72 78.95 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.962 0.505 . . . . 70.3 111.365 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.2 -38.32 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.789 0.836 . . . . 73.3 111.15 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.25 -53.59 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.771 0.828 . . . . 70.24 110.197 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -60.73 -33.05 72.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.848 0.859 . . . . 74.54 111.43 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -75.22 -53.17 9.25 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.293 0.637 . . . . 72.31 111.186 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.487 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 12.1 ptm180 -66.93 -30.44 70.58 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 111.753 0.279 . . . . 73.21 111.753 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.636 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.1 t -59.76 -17.89 38.93 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.861 1.264 . . . . 64.43 112.995 -175.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -53.32 -23.57 9.59 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.602 0.761 . . . . 60.34 112.332 173.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.72 -13.28 61.97 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.197 0.999 . . . . 71.54 112.066 -178.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.1 mmt -76.3 96.35 3.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.514 -0.551 . . . . 75.34 109.514 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -29.42 39.35 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.456 -0.942 . . . . 75.2 108.456 174.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.405 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 43.6 m-85 -99.97 175.99 5.58 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.439 1.096 . . . . 75.11 110.194 169.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.484 ' SG ' HG23 ' A' ' 85' ' ' ILE . 70.9 m 53.67 79.5 0.13 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.385 1.053 . . . . 74.14 110.138 -171.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -73.86 -61.21 1.93 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.551 -0.749 . . . . 75.25 109.591 -170.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 48.8 mttm -67.15 -39.52 86.55 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 114.416 -1.266 . . . . 74.3 111.781 -174.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.442 ' HG2' HH22 ' A' ' 30' ' ' ARG . 45.7 mt-30 -71.22 -31.45 67.6 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.07 0.548 . . . . 60.44 111.84 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.636 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 53.2 t -76.63 -40.79 48.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.315 0.646 . . . . 54.33 110.692 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 mtp-105 -65.39 -38.35 89.72 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.219 0.608 . . . . 74.24 110.657 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.611 HH22 ' HB3' ' A' ' 141' ' ' ALA . 6.5 mtp180 -66.44 -44.42 82.92 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.175 -0.917 . . . . 73.2 109.939 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.566 HD22 ' SG ' ' A' ' 18' ' ' CYS . 55.5 tp -56.08 -49.29 74.22 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.71 0.631 . . . . 72.34 110.776 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.36 -45.87 92.42 Favored Glycine 0 C--N 1.351 1.388 0 O-C-N 123.989 0.806 . . . . 53.5 112.166 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -60.93 -42.55 98.4 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.309 1.043 . . . . 74.52 111.49 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 57.1 mtt180 -59.22 -61.04 2.93 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.7 -0.852 . . . . 75.4 108.7 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.3 t -51.09 -49.04 29.74 Favored 'Isoleucine or valine' 0 C--N 1.353 0.75 0 O-C-N 125.47 1.731 . . . . 73.22 111.636 -175.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 97.1 mt -61.12 -43.61 98.62 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 124.097 0.873 . . . . 70.2 111.063 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.88 -25.59 74.18 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.553 0.533 . . . . 52.24 113.354 176.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.511 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 20.0 mt -82.89 -43.12 16.93 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.204 0.602 . . . . 72.14 111.127 -177.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.418 HG21 ' HA3' ' A' ' 11' ' ' GLY . 12.1 pt -79.07 -30.98 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.43 -0.795 . . . . 74.15 110.544 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.532 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 57.2 tptt -43.07 -59.45 3.11 Favored Pre-proline 0 N--CA 1.494 1.772 0 C-N-CA 124.346 1.058 . . . . 74.4 113.127 -178.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 26.0 Cg_exo -65.8 -31.62 47.98 Favored 'Trans proline' 0 C--N 1.392 2.835 0 C-N-CA 122.133 1.888 . . . . 75.44 112.609 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.482 ' HB3' HD13 ' A' ' 8' ' ' ILE . 3.4 mm? -79.44 -25.06 42.06 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.415 0.686 . . . . 74.12 110.768 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -73.01 -36.3 66.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.345 0.658 . . . . 74.14 109.324 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.7 mmt -63.79 -24.55 67.8 Favored 'General case' 0 N--CA 1.482 1.139 0 O-C-N 123.74 0.65 . . . . 70.44 110.529 175.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 77.2 mt -73.83 -64.01 1.09 Allowed 'General case' 0 C--N 1.355 0.814 0 N-CA-C 109.276 -0.639 . . . . 75.31 109.276 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -54.71 -34.65 62.71 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.182 0.808 . . . . 73.1 113.182 -167.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 122.403 0.281 . . . . 74.44 111.7 176.972 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 110.326 -0.25 . . . . 52.0 110.326 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -58.85 -45.17 90.71 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.978 0.511 . . . . 74.43 111.126 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -70.79 -34.68 72.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.279 0.631 . . . . 75.44 111.867 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.558 HD22 HD12 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -59.82 -49.26 78.42 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.182 -1.044 . . . . 73.14 108.182 176.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -64.98 -35.18 80.36 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.482 1.113 . . . . 74.42 111.014 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.2 m -59.33 -48.26 82.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.845 0.458 . . . . 73.34 110.54 176.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.98 -40.6 94.07 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.833 0.708 . . . . 73.21 110.98 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.54 ' HE3' ' HA ' ' A' ' 62' ' ' MET . 14.3 mmt -61.97 -41.36 97.91 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.542 0.737 . . . . 73.21 111.836 178.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -69.78 -39.1 76.83 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.444 0.698 . . . . 72.23 110.719 -178.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -65.76 -37.96 87.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.408 0.683 . . . . 75.22 110.884 176.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.511 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 1.7 t80 -70.05 -43.49 71.14 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.882 0.739 . . . . 73.22 109.969 -177.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -58.99 -50.26 74.76 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.669 1.188 . . . . 70.24 110.825 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.91 -41.42 97.9 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 124.019 0.824 . . . . 72.14 111.241 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.88 92.73 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.88 0.737 . . . . 72.14 111.169 179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.68 -43.71 92.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.084 0.554 . . . . 74.43 110.886 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.72 -34.02 76.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.451 0.701 . . . . 62.54 111.095 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 36.9 mm-40 -69.3 -42.93 74.78 Favored 'General case' 0 C--N 1.351 0.634 0 O-C-N 123.603 0.564 . . . . 73.13 111.349 175.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.48 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.066 0.546 . . . . 61.12 111.173 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -60.36 -44.54 95.49 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.17 0.988 . . . . 61.32 109.641 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -62.11 -36.73 93.37 Favored Glycine 0 C--N 1.347 1.183 0 O-C-N 124.239 0.962 . . . . 74.0 112.916 176.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 18.2 mm-40 -62.75 -56.93 13.13 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 117.273 0.536 . . . . 65.13 110.16 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.9 pt -65.56 -18.98 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 112.169 0.433 . . . . 64.35 112.169 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.487 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 27.2 tt0 -70.91 -39.91 72.45 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 122.691 0.396 . . . . 74.54 110.653 173.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 48.9 mttm -74.98 -30.23 61.12 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.899 0.381 . . . . 73.2 110.467 175.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.438 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.0 m-85 -81.36 0.03 39.12 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.662 0.785 . . . . 71.44 112.228 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.6 p -55.75 -34.79 65.52 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.82 0.819 . . . . 74.33 110.955 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.477 ' HB2' ' ND2' ' A' ' 84' ' ' ASN . 21.6 m-80 -93.67 113.5 25.6 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.164 -1.421 . . . . 73.2 107.164 168.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -69.76 -21.53 63.43 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.941 0.896 . . . . 74.52 110.843 -171.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.3 m -63.13 -33.46 75.5 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.917 0.887 . . . . 72.21 111.691 173.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.477 ' ND2' ' HB2' ' A' ' 81' ' ' ASN . 88.3 m-20 -67.09 -38.3 85.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.264 0.626 . . . . 73.41 110.228 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.578 HG21 HD13 ' A' ' 97' ' ' LEU . 52.2 mt -55.72 -60.86 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.967 0 O-C-N 124.082 0.864 . . . . 74.54 109.197 172.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 52.7 t -53.82 -37.78 63.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.08 0.952 . . . . 73.33 111.63 -177.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -58.78 -57.54 12.58 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.429 1.08 . . . . 71.23 111.033 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.51 -28.2 56.31 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 110.366 -0.235 . . . . 75.34 110.366 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -68.43 -39.7 81.43 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.454 1.102 . . . . 75.42 110.934 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.9 t -65.26 -31.25 72.31 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.626 0.579 . . . . 74.53 110.956 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.23 -1.26 31.58 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.833 0.853 . . . . 74.23 111.64 -177.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.471 0.608 0 C-N-CA 123.493 0.717 . . . . 70.43 111.139 -175.348 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.614 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 4.2 mp . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 107.696 -1.224 . . . . 74.41 107.696 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.578 HD13 HG21 ' A' ' 85' ' ' ILE . 10.9 tp -62.97 -29.6 70.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.062 0.945 . . . . 74.14 112.734 -172.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -120.33 8.63 10.85 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 117.999 -1.001 . . . . 71.45 111.211 -174.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.614 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 28.2 ttpt -35.68 -59.59 0.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 114.724 1.379 . . . . 74.53 114.724 -156.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 31.3 t70 -66.89 -42.98 84.61 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.63 0.772 . . . . 64.14 111.563 -175.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.59 -38.02 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.242 0.617 . . . . 65.32 110.179 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -80.27 -18.16 50.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.42 0.688 . . . . 70.53 110.233 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -73.68 -34.0 64.69 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.505 -0.924 . . . . 75.02 108.505 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 48.3 mttm -62.9 -46.47 87.68 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.482 -0.562 . . . . 72.14 109.482 170.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.23 -43.29 78.47 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 123.336 0.397 . . . . 64.55 110.902 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t -70.46 -34.95 73.01 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.332 0.653 . . . . 61.44 111.332 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 18.0 t70 -72.27 -55.53 7.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.982 0.913 . . . . 72.41 109.496 -176.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.87 -53.76 38.33 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 114.907 -1.042 . . . . 75.44 109.598 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -61.5 -37.97 85.61 Favored 'General case' 0 C--N 1.357 0.93 0 CA-C-O 118.364 -0.827 . . . . 75.2 112.831 -175.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.7 ptmt -65.39 -47.64 75.65 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.556 1.071 . . . . 74.32 108.921 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.03 -35.59 80.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 120.93 0.395 . . . . 74.51 110.899 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.422 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 7.3 tt -72.82 -44.42 61.5 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.803 1.241 . . . . 73.35 110.023 -173.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.449 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 31.1 t -67.4 -40.93 85.66 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.349 0.66 . . . . 74.12 109.444 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 92.5 mt -64.13 -39.74 94.68 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 123.504 0.502 . . . . 73.43 112.019 178.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.558 HD12 HD22 ' A' ' 58' ' ' LEU . 4.2 pp -73.88 -25.25 59.93 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.064 0.393 . . . . 71.13 110.515 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.57 HD12 ' SD ' ' A' ' 122' ' ' MET . 89.8 mt -69.67 -32.01 70.4 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 119.61 -0.233 . . . . 72.12 110.393 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 113' ' ' SER . 24.0 mm-40 -67.21 -52.35 42.22 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.803 0.441 . . . . 71.55 110.063 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -76.26 -60.31 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.326 -0.852 . . . . 75.1 111.384 -172.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.44 -56.23 7.12 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.763 0.425 . . . . 74.24 111.239 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -95.97 -11.55 26.37 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.267 0.84 . . . . 75.41 113.267 -168.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 55.28 71.41 0.54 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.809 0.844 . . . . 74.14 111.393 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.57 ' SD ' HD12 ' A' ' 116' ' ' LEU . 55.7 ttm -104.84 123.5 39.82 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 122.997 0.519 . . . . 71.32 110.115 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo . . . . . 0 C--N 1.365 1.396 0 C-N-CA 122.499 2.133 . . . . 75.05 112.396 175.595 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 36.2 m0 . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.373 0.13 . . . . 72.53 111.057 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.77 -19.93 60.29 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 112.51 0.559 . . . . 64.42 112.51 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -91.41 -60.68 1.83 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.868 0.867 . . . . 74.32 110.783 170.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.48 -62.68 1.52 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.785 1.234 . . . . 74.41 111.55 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.69 66.82 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.344 -1.298 . . . . 75.32 111.527 -176.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . 0.426 ' HA ' HD13 ' A' ' 96' ' ' ILE . 36.2 tt0 -72.34 -56.21 5.86 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.65 0.594 . . . . 72.12 111.601 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.418 ' O ' ' HB3' ' A' ' 142' ' ' ASP . 13.5 mm100 -69.22 -28.03 66.0 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.729 0.643 . . . . 74.54 111.407 -176.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -86.74 -28.46 23.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.952 -0.567 . . . . 65.43 110.593 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.611 ' HB3' HH22 ' A' ' 30' ' ' ARG . . . -72.34 -26.56 61.97 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 109.825 -0.435 . . . . 73.45 109.825 168.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 139' ' ' GLN . 25.5 t70 -62.58 -52.66 62.53 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 123.933 0.77 . . . . 53.35 108.941 172.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -60.87 -37.27 81.56 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.603 1.19 . . . . 74.14 113.138 174.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.9 t0 -76.94 -46.28 24.74 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.022 0.378 . . . . 74.04 112.022 -174.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.41 -36.54 84.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.492 0.717 . . . . 75.22 110.487 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -57.33 -47.21 82.17 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 115.565 -0.743 . . . . 72.42 109.507 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.35 -32.8 74.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.168 0.917 . . . . 75.22 111.889 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.405 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 1.1 t80 -65.24 -43.14 92.36 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.237 0.615 . . . . 73.51 109.854 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -85.07 -20.34 30.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.136 0.574 . . . . 71.44 111.645 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -79.67 -62.69 1.61 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.03 0.532 . . . . 73.14 109.933 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 92.9 mt . . . . . 0 N--CA 1.489 1.511 0 C-N-CA 126.277 1.831 . . . . 73.44 113.619 -179.691 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 111.93 0.344 . . . . 63.24 111.93 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.96 -32.52 72.96 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.949 0.499 . . . . 72.52 111.338 177.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.471 ' O ' ' HB ' ' A' ' 7' ' ' ILE . 5.9 tt -68.3 -39.64 81.99 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.391 0.676 . . . . 75.15 109.363 174.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -68.13 -29.85 68.85 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.199 0.2 . . . . 74.53 110.802 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -70.59 -34.74 72.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 119.159 -0.448 . . . . 72.11 110.416 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 4' ' ' LEU . 61.2 mt -56.26 -47.88 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.679 0.792 . . . . 74.44 110.085 169.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.2 mm -59.36 -46.93 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 115.249 -0.887 . . . . 65.23 111.16 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' HG22 ' A' ' 13' ' ' VAL . 87.2 m -60.8 -47.46 86.23 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.876 0.871 . . . . 71.41 110.757 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -57.81 -50.62 72.67 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 123.948 0.78 . . . . 75.31 110.76 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.06 -35.05 91.5 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.602 1.189 . . . . 63.55 113.487 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -72.39 -39.71 67.79 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 122.686 0.395 . . . . 74.31 110.194 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.438 HG11 HD22 ' A' ' 73' ' ' ASN . 98.6 t -72.96 -26.73 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.275 0.63 . . . . 74.2 110.257 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.574 HG21 HG22 ' A' ' 35' ' ' VAL . 26.4 mt -60.13 -53.49 47.94 Favored 'Isoleucine or valine' 0 C--N 1.361 1.068 0 N-CA-C 108.897 -0.779 . . . . 70.22 108.897 171.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -57.23 -41.09 78.86 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.321 1.013 . . . . 74.34 110.94 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -53.84 -59.64 4.36 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 124.169 0.918 . . . . 74.0 112.103 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -84.13 -16.56 43.16 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 113.703 1.001 . . . . 74.22 113.703 -172.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.51 -20.55 65.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.952 0.901 . . . . 74.11 111.952 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -58.46 -19.48 37.11 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 113.269 0.84 . . . . 65.5 113.269 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -67.19 -20.2 65.68 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.804 0.668 . . . . 74.55 112.804 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.3 mmt -79.12 85.4 5.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.251 0.548 . . . . 73.11 110.752 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -75.21 -33.87 61.43 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.609 -1.256 . . . . 74.1 107.609 166.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.508 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 46.4 m-85 -92.33 162.87 14.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 114.619 -1.173 . . . . 73.32 110.37 173.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.407 ' SG ' HD11 ' A' ' 97' ' ' LEU . 68.9 m 54.32 65.55 1.48 Allowed 'General case' 0 C--N 1.354 0.766 0 O-C-N 124.636 1.21 . . . . 52.13 109.637 -170.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.456 ' HG3' ' HG3' ' A' ' 26' ' ' LYS . 49.4 pttt -53.22 -50.07 65.48 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 114.771 -1.104 . . . . 72.22 110.524 -174.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 5.5 mtpm? -80.77 -25.43 37.95 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-O 118.349 -0.834 . . . . 73.41 111.322 -172.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.817 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 18.1 mm-40 -70.56 -36.33 73.57 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 119.196 0.907 . . . . 74.41 109.775 175.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.0 t -67.08 -45.81 76.17 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 74.12 110.359 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.84 -33.4 66.13 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.327 -0.851 . . . . 73.53 111.238 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.688 HH22 ' HB1' ' A' ' 141' ' ' ALA . 16.6 ttm180 -69.99 -45.81 66.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.462 -0.57 . . . . 72.23 109.462 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.442 HD21 HD11 ' A' ' 76' ' ' ILE . 41.8 tp -62.89 -46.14 89.26 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 124.114 0.884 . . . . 75.53 109.696 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.52 -47.3 91.4 Favored Glycine 0 C--N 1.346 1.086 0 O-C-N 123.723 0.639 . . . . 74.33 112.614 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -60.67 -49.74 76.32 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.71 0.804 . . . . 75.43 111.12 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.513 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 17.1 mtt180 -61.66 -64.12 1.04 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.754 -1.112 . . . . 72.03 109.955 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.574 HG22 HG21 ' A' ' 14' ' ' ILE . 61.2 t -56.07 -46.73 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 124.14 0.9 . . . . 74.53 111.929 -171.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.232 0.332 . . . . 75.31 110.502 176.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.0 -20.0 74.26 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 114.307 0.483 . . . . 74.14 114.307 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 49.5 mt -87.23 -46.82 9.38 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.504 0.722 . . . . 75.43 110.792 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.424 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 12.4 pt -77.75 -38.9 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-O 118.925 -0.56 . . . . 74.11 111.482 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -56.48 -46.06 99.86 Favored Pre-proline 0 N--CA 1.487 1.386 0 N-CA-C 113.795 1.035 . . . . 74.23 113.795 -171.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -54.44 -51.67 9.98 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 121.581 1.521 . . . . 74.51 111.276 172.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.77 -31.28 72.22 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 115.452 -0.794 . . . . 74.33 111.662 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -66.44 -60.5 2.68 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.748 0.819 . . . . 75.51 110.576 178.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.2 ptp -61.11 -36.33 79.43 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 124.111 0.882 . . . . 73.34 111.455 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.602 HD13 ' SD ' ' A' ' 122' ' ' MET . 82.9 mt -67.42 -47.59 69.78 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.504 0.721 . . . . 74.42 110.305 177.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -61.57 -35.07 76.75 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.811 0.694 . . . . 74.43 111.727 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 . . . . . 0 N--CA 1.483 1.214 0 C-N-CA 123.085 0.554 . . . . 74.1 111.437 -179.809 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.432 ' HG ' HD22 ' A' ' 58' ' ' LEU . 81.1 p . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.89 0.376 . . . . 62.51 110.952 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.56 -33.95 76.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.127 -0.942 . . . . 73.25 110.228 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.531 ' HB3' HD22 ' A' ' 115' ' ' LEU . 35.7 mtmm -58.1 -55.18 38.26 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.589 0.756 . . . . 71.11 110.573 174.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.541 HD23 HD13 ' A' ' 115' ' ' LEU . 4.4 mm? -59.82 -49.38 77.92 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.646 0.778 . . . . 74.33 111.537 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.8 m -58.41 -50.42 73.74 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 123.931 0.769 . . . . 73.3 111.206 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.6 m -68.82 -36.51 78.31 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.319 0.648 . . . . 74.11 111.53 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.79 -44.24 74.0 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.645 -0.502 . . . . 75.21 109.645 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -40.33 96.66 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.987 -1.006 . . . . 71.12 111.44 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -66.83 -42.49 85.72 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.202 0.601 . . . . 73.11 111.538 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -69.15 -42.15 76.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.62 0.768 . . . . 73.25 111.027 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.412 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 20.1 t80 -71.03 -37.79 72.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.132 0.973 . . . . 73.44 110.102 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.5 ttpp -61.75 -51.19 69.37 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.289 -0.868 . . . . 74.54 109.077 174.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.66 -41.31 73.45 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.17 0.919 . . . . 75.21 111.713 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 105' ' ' LEU . . . -62.27 -43.41 98.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.967 -1.015 . . . . 64.52 111.746 177.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.8 mt -75.79 -25.96 56.86 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.171 0.588 . . . . 72.11 112.214 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 52.8 mt-10 -65.74 -45.77 81.36 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.215 0.606 . . . . 75.52 109.404 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.17 -39.25 78.85 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.637 -1.165 . . . . 74.22 111.011 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -64.08 -43.37 95.62 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.5 0.5 . . . . 54.33 110.736 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.438 HD22 HG11 ' A' ' 13' ' ' VAL . 11.3 t-20 -61.59 -46.73 88.62 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 124.547 1.154 . . . . 75.11 109.734 179.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -61.22 -42.11 99.69 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.081 -0.963 . . . . 73.34 112.446 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -59.41 -53.15 61.44 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 118.931 -0.557 . . . . 73.33 111.667 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.501 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -65.71 -28.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 N-CA-C 112.446 0.536 . . . . 73.41 112.446 178.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -64.64 -33.13 75.22 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.444 0.298 . . . . 74.25 110.687 172.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 42.2 mttm -85.5 -28.09 25.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.021 0.529 . . . . 72.22 111.012 176.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.501 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.3 m-85 -76.67 -2.84 34.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.935 0.894 . . . . 75.03 112.135 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -57.69 -25.32 60.11 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.346 0.659 . . . . 73.0 110.378 170.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -84.46 107.29 16.63 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 107.712 -1.218 . . . . 74.41 107.712 164.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -72.91 -23.65 60.73 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.469 0.708 . . . . 73.01 110.736 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.2 p -68.73 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.128 0.971 . . . . 74.25 111.335 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -61.4 -41.6 97.4 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.79 0.836 . . . . 74.22 110.236 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.578 HG23 HD13 ' A' ' 97' ' ' LEU . 39.3 mt -56.89 -60.15 2.31 Favored 'Isoleucine or valine' 0 C--N 1.354 0.794 0 CA-C-N 115.109 -0.95 . . . . 74.54 109.479 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.2 t -58.27 -34.51 70.58 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 123.964 0.79 . . . . 71.55 111.631 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -59.63 -56.45 21.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.977 1.311 . . . . 73.41 110.885 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.91 -22.23 42.99 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.853 -0.158 . . . . 75.24 110.583 -177.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.2 tp -76.27 -33.96 59.12 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.58 0.752 . . . . 64.34 111.081 -172.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.3 t -68.95 -25.05 64.36 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 110.065 -0.346 . . . . 72.13 110.065 173.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.82 17.62 22.29 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.433 1.093 . . . . 72.13 111.326 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 91.3 p . . . . . 0 C--N 1.359 0.999 0 N-CA-C 109.276 -0.638 . . . . 74.43 109.276 179.617 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 108.985 -0.746 . . . . 75.14 108.985 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.817 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.0 tp -60.6 -40.67 92.65 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.694 0.759 . . . . 72.22 111.968 -171.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.417 ' HB3' ' HB ' ' A' ' 101' ' ' VAL . 5.0 m-85 -112.02 38.03 2.8 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.992 -1.004 . . . . 73.42 108.528 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.417 ' HE3' ' HB2' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -39.49 -53.53 2.05 Favored 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 113.568 0.951 . . . . 74.12 113.568 -160.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.54 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 34.6 t70 -80.07 -40.7 27.09 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.372 0.669 . . . . 73.42 110.74 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 98' ' ' PHE . 56.3 t -62.91 -54.43 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.644 0.777 . . . . 73.15 111.371 -177.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -69.45 -26.06 64.4 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.034 0.934 . . . . 71.43 111.213 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -35.75 77.14 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.105 0.412 . . . . 73.42 110.993 164.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.9 mttm -66.01 -44.79 83.72 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.221 -0.659 . . . . 74.41 109.221 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 68' ' ' ALA . 10.8 mp -53.47 -44.89 69.31 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.354 0.409 . . . . 75.32 109.972 174.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.423 ' HA ' ' CZ3' ' A' ' 133' ' ' TRP . 21.1 m -62.88 -57.64 10.12 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.776 0.673 . . . . 75.31 112.108 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.67 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.1 t70 -72.43 -41.71 65.87 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 114.865 -1.061 . . . . 51.14 110.692 -169.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 51.4 t -74.2 -28.79 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 115.862 -0.608 . . . . 75.22 110.882 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.403 ' CD2' HD21 ' A' ' 38' ' ' LEU . 62.5 t-105 -67.83 -37.91 82.54 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.37 0.532 . . . . 72.43 110.439 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.67 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.7 mtpt -55.12 -52.73 62.33 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.523 -0.547 . . . . 75.11 109.523 173.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 39.7 mt-10 -53.74 -51.73 62.39 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 124.424 1.078 . . . . 75.51 111.028 174.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.579 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -66.06 -55.24 17.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.054 0.942 . . . . 73.53 109.651 -168.464 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.2 p -59.63 -40.34 87.32 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.394 0.678 . . . . 74.41 112.0 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.7 pp -64.08 -43.01 96.71 Favored 'General case' 0 C--N 1.37 1.457 0 CA-C-N 118.139 0.427 . . . . 72.44 110.839 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.541 HD13 HD23 ' A' ' 58' ' ' LEU . 4.2 pp -74.6 -20.99 59.71 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.476 0.547 . . . . 73.01 112.476 177.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 43.0 mt -69.42 -36.78 77.03 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 110.041 -0.355 . . . . 75.02 110.041 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.479 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.02 -38.34 44.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.321 0.648 . . . . 74.24 111.419 178.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 49.9 t -74.57 -62.63 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.339 0.656 . . . . 75.4 111.138 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -89.8 -57.11 2.98 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 122.383 -0.198 . . . . 64.01 111.382 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 116' ' ' LEU . 31.7 mm-40 -67.12 -23.19 65.79 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.638 0.586 . . . . 70.14 111.899 -172.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 56.89 32.22 21.07 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.332 1.053 . . . . 75.53 111.848 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.602 ' SD ' HD13 ' A' ' 45' ' ' LEU . 41.4 mtm -91.29 146.17 32.91 Favored Pre-proline 0 N--CA 1.467 0.422 0 N-CA-C 108.818 -0.808 . . . . 75.12 108.818 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo . . . . . 0 C--N 1.371 1.748 0 C-N-CA 123.06 2.507 . . . . 73.33 112.287 -173.91 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.423 ' CZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 111.558 0.207 . . . . 74.05 111.558 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -32.33 73.82 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.697 0.399 . . . . 75.32 111.424 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . 0.428 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 46.7 mt-30 -84.12 -37.87 21.43 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.775 0.83 . . . . 75.34 110.838 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.85 -52.65 64.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.42 1.088 . . . . 75.51 110.73 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.69 -37.28 86.02 Favored 'General case' 0 C--O 1.239 0.506 0 O-C-N 124.665 1.228 . . . . 65.33 112.907 -174.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.73 -48.68 63.18 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 109.922 -0.399 . . . . 75.24 109.922 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -63.37 -37.9 89.08 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.298 0.571 . . . . 74.13 111.441 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.13 -49.54 76.82 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.408 1.083 . . . . 71.52 109.722 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.688 ' HB1' HH22 ' A' ' 30' ' ' ARG . . . -74.51 -21.14 59.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.074 -0.966 . . . . 72.12 112.052 -178.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -64.81 -54.41 31.62 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.89 -0.781 . . . . 74.3 108.89 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.27 -39.35 92.49 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.269 0.981 . . . . 71.12 110.502 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.484 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 39.5 t0 -74.37 -48.52 27.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.661 -0.699 . . . . 74.53 112.163 -174.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 36.6 ttt-85 -65.65 -34.37 78.06 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.527 -0.546 . . . . 75.35 109.527 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -57.96 -48.68 79.25 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 123.603 0.565 . . . . 75.51 109.648 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.58 77.58 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.885 0.741 . . . . 73.23 111.8 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.508 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.9 OUTLIER -72.98 -49.18 30.56 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.612 0.57 . . . . 75.02 110.448 -178.722 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -81.55 -10.68 59.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.757 -0.656 . . . . 72.05 111.765 -172.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -96.24 -59.82 1.75 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.144 -1.058 . . . . 73.13 108.144 173.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.944 0 C-N-CA 125.957 1.703 . . . . 72.3 112.341 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 N--CA 1.476 0.851 0 N-CA-C 110.179 -0.304 . . . . 74.22 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.497 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 95.7 m-20 -58.45 -46.69 86.05 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.667 -0.697 . . . . 75.04 110.342 174.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.461 ' O ' HG12 ' A' ' 8' ' ' ILE . 42.6 mt -63.78 -40.49 96.8 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.863 0.727 . . . . 73.22 111.134 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -59.52 -48.42 81.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.762 -0.829 . . . . 64.53 108.762 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -66.08 -49.12 68.69 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-O 118.901 -0.571 . . . . 73.13 111.118 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.2 mt -54.42 -47.65 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.831 0.852 . . . . 72.52 111.275 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 4' ' ' LEU . 20.8 mm -66.78 -46.74 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.166 -0.925 . . . . 74.1 110.958 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -63.19 -44.0 96.59 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.536 0.522 . . . . 72.32 110.646 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.8 mt -55.49 -58.93 5.73 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.41 0.684 . . . . 72.54 109.835 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.81 -38.33 95.78 Favored Glycine 0 C--N 1.348 1.245 0 O-C-N 124.443 1.089 . . . . 71.43 114.609 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -70.98 -47.65 57.72 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 123.192 0.597 . . . . 72.02 110.259 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.434 HG13 ' HD2' ' A' ' 17' ' ' ARG . 90.6 t -64.48 -31.35 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 115.631 -0.713 . . . . 75.15 110.01 174.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.549 HG12 HD13 ' A' ' 76' ' ' ILE . 14.5 mt -59.02 -49.89 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.946 0.899 . . . . 72.32 109.712 174.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -60.44 -42.49 96.21 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 123.946 0.779 . . . . 74.53 111.322 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -67.11 -58.04 5.64 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.309 0.381 . . . . 73.52 111.456 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.434 ' HD2' HG13 ' A' ' 13' ' ' VAL . 1.4 ptm180 -72.07 -19.78 61.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.742 0.817 . . . . 73.04 112.992 -167.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 35.1 t -61.66 -16.04 45.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.919 0.888 . . . . 72.24 112.059 176.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -55.01 -12.81 0.92 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.006 1.113 . . . . 74.42 114.006 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -66.24 -18.73 65.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.381 0.673 . . . . 74.32 112.609 176.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.501 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 7.7 mmt -70.55 93.64 0.92 Allowed 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.081 0.467 . . . . 75.51 110.716 -175.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.547 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 11.3 mmmm -68.76 -43.93 74.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.016 0.926 . . . . 75.3 110.252 171.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -101.97 175.05 5.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.833 -1.531 . . . . 72.14 109.546 166.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.493 ' SG ' HG21 ' A' ' 85' ' ' ILE . 83.5 m 58.52 45.04 16.99 Favored 'General case' 0 C--O 1.243 0.735 0 O-C-N 124.095 0.872 . . . . 73.01 110.844 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -74.37 -45.23 48.3 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 114.627 -1.169 . . . . 72.42 110.658 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.9 mtpm? -65.07 -33.5 76.17 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.07 -0.715 . . . . 75.1 109.07 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.455 ' HB2' ' OD1' ' A' ' 144' ' ' ASP . 3.1 tp-100 -55.41 -47.02 76.56 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 123.893 0.746 . . . . 70.05 110.492 170.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 42.5 t -73.98 -21.97 59.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.201 1.0 . . . . 74.52 112.031 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -45.78 53.73 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.426 0.691 . . . . 73.41 109.739 174.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.432 ' NH2' ' HB1' ' A' ' 141' ' ' ALA . 21.9 ttp85 -75.33 -39.32 59.54 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.456 -0.793 . . . . 73.11 110.856 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.7 tp -62.86 -44.44 96.13 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.826 -0.805 . . . . 71.41 108.826 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.21 -52.67 47.98 Favored Glycine 0 C--N 1.349 1.267 0 O-C-N 124.384 1.053 . . . . 74.42 112.025 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -69.45 -34.12 73.93 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.092 0.557 . . . . 75.25 112.424 -177.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.635 HH12 ' HB2' ' A' ' 106' ' ' SER . 14.4 mtt180 -65.45 -58.81 4.92 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.092 -0.707 . . . . 72.24 109.092 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 39' ' ' ILE . 53.3 t -55.89 -44.81 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 124.435 1.084 . . . . 73.22 111.279 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.436 HD22 HD13 ' A' ' 39' ' ' ILE . 75.6 mt -62.14 -38.83 90.46 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.643 0.589 . . . . 74.44 110.666 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -71.89 -20.5 78.83 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.803 -0.443 . . . . 73.34 113.563 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 60.8 mt -85.71 -45.98 11.14 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.044 0.537 . . . . 71.4 111.137 177.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.436 HD13 HD22 ' A' ' 36' ' ' LEU . 14.3 pt -78.34 -43.22 26.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 118.869 -0.586 . . . . 71.44 110.904 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -52.4 -53.65 50.83 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 114.37 1.248 . . . . 75.11 114.37 -173.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.35 -32.64 81.37 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.768 1.645 . . . . 73.42 112.459 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 46' ' ' GLN . 4.3 mm? -75.16 -37.01 61.48 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.757 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -67.06 -40.5 87.09 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.585 1.154 . . . . 75.42 111.25 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.454 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 30.0 mmt -60.67 -40.28 91.52 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.984 0.803 . . . . 75.12 110.542 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.9 mt -80.7 -26.33 37.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.615 0.766 . . . . 75.41 111.481 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -74.76 -29.22 61.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.106 0.962 . . . . 72.45 109.942 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.306 0.642 . . . . 75.11 110.899 175.75 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.504 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 43.6 t . . . . . 0 C--O 1.242 0.682 0 N-CA-C 109.806 -0.442 . . . . 74.43 109.806 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.41 -27.85 65.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.69 -0.687 . . . . 54.11 110.602 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -74.2 -30.54 62.25 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.859 0.464 . . . . 73.1 111.028 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.504 ' HG ' ' HB3' ' A' ' 55' ' ' SER . 59.1 mt -69.46 -41.77 75.78 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.437 0.461 . . . . 74.23 109.978 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.4 m -61.14 -49.0 79.04 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 124.181 0.925 . . . . 70.1 109.933 175.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 79.9 m -60.98 -40.43 93.43 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.75 0.656 . . . . 74.52 111.24 178.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.29 -50.11 72.97 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.684 0.794 . . . . 74.25 110.854 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.497 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.6 mmt -72.63 -19.38 61.46 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 115.271 -0.877 . . . . 70.31 112.34 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.475 ' HA ' ' HZ3' ' A' ' 66' ' ' LYS . 93.2 m-20 -78.22 -44.12 26.51 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 122.916 0.486 . . . . 70.45 110.248 174.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -60.6 -46.18 91.2 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.191 0.996 . . . . 74.11 109.914 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.418 ' O ' HD22 ' A' ' 69' ' ' LEU . 1.9 t80 -65.83 -50.92 62.89 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 114.569 -1.196 . . . . 72.44 109.444 -176.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.487 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 ttpm? -54.45 -46.57 73.31 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.455 0.702 . . . . 74.22 111.065 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.99 -43.71 94.99 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 124.038 0.836 . . . . 74.22 111.17 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.456 ' HB1' HD13 ' A' ' 105' ' ' LEU . . . -66.57 -39.2 88.36 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.632 -0.713 . . . . 73.55 111.546 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.418 HD22 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -65.64 -34.15 77.55 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.22 1.008 . . . . 71.01 111.299 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 80.9 mm-40 -61.06 -49.7 76.29 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.313 0.645 . . . . 73.05 109.283 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 33.7 mt-10 -59.32 -44.19 92.61 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.291 -1.322 . . . . 74.33 111.032 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.55 -42.98 99.88 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 123.914 0.759 . . . . 75.4 111.34 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -61.47 -36.42 80.39 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.812 0.695 . . . . 72.52 110.101 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -70.2 -36.72 71.43 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 114.83 -1.077 . . . . 65.44 112.328 177.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 11.5 mm-40 -62.63 -51.43 67.31 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 122.881 0.472 . . . . 54.11 109.774 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.556 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 2.3 pt -74.63 -19.39 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 112.566 0.58 . . . . 73.0 112.566 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.79 -40.63 93.35 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.606 -0.516 . . . . 71.3 109.606 167.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 77.1 mttt -74.77 -45.42 43.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.498 0.719 . . . . 73.52 110.616 175.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.556 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.5 m-30 -73.32 -4.28 32.32 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.116 0.966 . . . . 72.33 112.542 -173.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.9 p -57.33 -32.12 66.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.083 0.553 . . . . 72.54 110.234 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -84.43 118.8 24.49 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.149 -0.932 . . . . 72.44 109.265 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.547 ' HG2' ' HB2' ' A' ' 22' ' ' LYS . 4.1 mpt_? -74.14 -31.72 62.86 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.429 1.092 . . . . 74.45 110.046 -176.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.7 m -64.93 -36.05 83.14 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.813 -1.085 . . . . 74.31 111.04 174.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.4 -40.7 97.92 Favored 'General case' 0 C--O 1.252 1.185 0 C-N-CA 123.436 0.695 . . . . 74.42 110.532 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.493 HG21 ' SG ' ' A' ' 24' ' ' CYS . 21.8 mt -58.91 -55.48 23.08 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 O-C-N 124.133 0.895 . . . . 75.21 109.536 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.7 t -56.22 -40.03 73.41 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.862 0.726 . . . . 65.14 111.911 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.8 -46.09 91.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.92 0.888 . . . . 73.43 111.452 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.28 -22.96 30.54 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 119.552 -0.261 . . . . 73.34 110.648 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 tp -73.3 -36.57 66.3 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.85 0.86 . . . . 75.31 110.662 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -74.65 -14.49 60.76 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.119 -0.946 . . . . 64.32 110.28 175.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -108.82 11.15 26.4 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.541 1.136 . . . . 73.42 110.163 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.7 t . . . . . 0 C--N 1.354 0.787 0 C-N-CA 124.035 0.934 . . . . 73.42 108.932 177.769 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.7 mp . . . . . 0 CA--C 1.539 0.53 0 N-CA-C 109.133 -0.692 . . . . 74.51 109.133 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.483 HD12 HG22 ' A' ' 85' ' ' ILE . 12.0 tp -60.68 -30.87 70.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.968 1.307 . . . . 74.11 111.875 -175.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -111.65 13.06 21.21 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.679 -1.153 . . . . 74.11 111.423 -175.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -37.15 -57.86 0.84 Allowed 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 114.512 1.301 . . . . 73.23 114.512 -159.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 16.3 t70 -54.84 -62.44 1.66 Allowed 'General case' 0 N--CA 1.479 0.983 0 O-C-N 124.432 1.083 . . . . 74.43 110.749 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.03 -49.04 85.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 CA-C-N 114.903 -1.044 . . . . 73.55 111.676 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.7 -28.62 67.01 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.344 0.658 . . . . 74.44 111.331 -175.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -69.65 -34.17 73.64 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.366 -0.605 . . . . 74.13 109.366 172.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.1 mtpt -66.74 -42.64 85.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 119.148 -0.453 . . . . 72.35 110.873 174.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.456 HD13 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -59.83 -40.11 87.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 109.762 -0.458 . . . . 75.54 109.762 171.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.635 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.6 t -66.86 -42.53 85.52 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.765 0.666 . . . . 71.32 111.758 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -70.14 -47.63 60.88 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.659 0.783 . . . . 73.4 109.856 -177.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 45.6 t -72.88 -21.7 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.171 -0.922 . . . . 75.24 110.873 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.418 ' HA ' ' HB2' ' A' ' 112' ' ' LEU . 42.5 t-105 -78.54 -35.24 46.44 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 118.469 0.577 . . . . 74.24 110.855 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -57.71 -52.52 65.1 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.616 -0.883 . . . . 74.33 108.616 172.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 49.7 mt-10 -57.69 -49.3 76.95 Favored 'General case' 0 C--N 1.351 0.631 0 CA-C-N 114.359 -1.291 . . . . 65.25 110.261 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.5 OUTLIER -54.75 -60.5 3.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.512 1.132 . . . . 75.51 109.444 -174.503 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 84.4 p -59.18 -37.19 76.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.269 -0.878 . . . . 73.12 111.501 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.5 -57.29 8.6 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 111.922 0.341 . . . . 74.45 111.922 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 3.6 pp -66.28 -35.28 79.99 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-N 117.982 0.355 . . . . 72.52 111.6 -175.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.534 HD22 ' SD ' ' A' ' 122' ' ' MET . 94.1 mt -67.82 -50.94 53.96 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 123.183 0.593 . . . . 74.4 110.57 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.16 -45.71 69.36 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.118 0.485 . . . . 74.03 112.062 -173.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 94.0 t -84.76 -42.41 16.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-N 115.378 -0.828 . . . . 75.0 111.39 -171.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.5 -57.75 2.31 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 109.47 -0.567 . . . . 75.53 109.47 -175.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -11.85 59.89 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 123.521 0.729 . . . . 73.01 111.308 -174.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 65.57 44.15 3.11 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 125.259 1.424 . . . . 72.33 112.017 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.534 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.5 mtp -110.5 112.63 56.56 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.49 1.116 . . . . 64.3 109.8 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo . . . . . 0 C--N 1.372 1.763 0 C-N-CA 122.887 2.391 . . . . 71.32 112.061 -177.807 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.51 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 5.8 t90 . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 111.344 0.127 . . . . 73.42 111.344 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.22 -39.84 20.41 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.736 0.814 . . . . 63.55 111.491 173.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -67.74 -34.31 76.58 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.857 0.863 . . . . 74.22 111.518 -173.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.72 -35.08 70.19 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.47 -1.241 . . . . 74.51 111.024 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.66 -43.45 89.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.157 0.583 . . . . 73.5 111.557 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.47 -59.81 4.3 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.941 0.776 . . . . 74.31 110.259 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 29.4 tt0 -60.41 -54.18 48.64 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.197 0.936 . . . . 72.54 111.846 -175.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.41 -49.86 75.18 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.195 0.934 . . . . 74.53 110.857 -173.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.432 ' HB1' ' NH2' ' A' ' 30' ' ' ARG . . . -66.71 -31.28 71.84 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 124.159 0.912 . . . . 71.15 111.432 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.27 -52.66 62.81 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 123.636 0.585 . . . . 73.4 110.12 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 41.0 mt-10 -60.27 -36.08 77.0 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.263 0.977 . . . . 74.43 111.458 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.508 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.9 t70 -75.73 -50.21 15.98 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.371 1.068 . . . . 74.12 112.045 -172.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -66.03 -33.34 75.59 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.148 -0.686 . . . . 75.22 109.148 175.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -67.35 -32.23 73.03 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.048 0.539 . . . . 74.52 109.988 174.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.59 -21.86 60.2 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.244 0.618 . . . . 73.54 111.335 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -54.91 12.12 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.394 -0.595 . . . . 74.22 109.394 169.303 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.56 -47.52 85.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.386 0.674 . . . . 75.32 111.565 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 40.6 ttm -84.76 -72.74 0.46 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.599 0.76 . . . . 74.4 109.441 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 35.5 tp . . . . . 0 CA--C 1.551 0.988 0 C-N-CA 125.347 1.459 . . . . 63.23 112.331 -178.02 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 110.605 -0.146 . . . . 74.34 110.605 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.622 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 16.4 m120 -59.15 -59.7 5.04 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 123.891 0.745 . . . . 74.44 109.934 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 8' ' ' ILE . 56.8 mt -61.91 -39.53 92.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 124.29 0.994 . . . . 75.32 112.165 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.28 -48.06 81.66 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.431 0.692 . . . . 72.12 109.91 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -72.38 -41.57 66.2 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-O 118.766 -0.635 . . . . 75.15 111.528 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.6 mt -52.56 -49.26 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.648 0.779 . . . . 74.42 110.673 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 4' ' ' LEU . 28.6 mm -71.69 -41.53 71.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 114.685 -1.143 . . . . 63.53 111.202 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -61.51 -59.12 5.72 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 122.893 0.477 . . . . 73.33 110.053 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.413 ' O ' HG13 ' A' ' 14' ' ' ILE . 27.2 mt -52.06 -49.4 63.55 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.309 1.044 . . . . 73.01 111.517 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.48 ' HA2' HD11 ' A' ' 14' ' ' ILE . . . -64.08 -39.05 96.83 Favored Glycine 0 C--N 1.351 1.383 0 O-C-N 123.955 0.785 . . . . 70.1 114.081 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -69.47 -44.26 71.55 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 109.284 -0.636 . . . . 75.43 109.284 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.454 HG12 ' HD2' ' A' ' 17' ' ' ARG . 69.5 t -61.88 -31.35 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.2 1.0 . . . . 74.21 111.013 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.493 HG22 HG23 ' A' ' 35' ' ' VAL . 68.3 mt -61.03 -53.26 51.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 109.047 -0.723 . . . . 73.12 109.047 172.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -58.33 -30.61 66.84 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 123.884 0.74 . . . . 72.4 112.142 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -76.45 -51.44 11.78 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.893 0.477 . . . . 73.32 111.672 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.454 ' HD2' HG12 ' A' ' 13' ' ' VAL . 9.7 ptm180 -84.47 -19.53 33.21 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.977 0.511 . . . . 74.14 112.235 -169.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.62 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 21.8 t -71.17 -19.84 62.36 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.499 0.72 . . . . 74.1 110.413 177.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -63.88 -13.17 42.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.284 0.634 . . . . 74.52 111.675 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -28.54 70.14 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.491 0.717 . . . . 75.15 110.247 174.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.6 mmt -70.31 89.24 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.126 0.571 . . . . 74.41 110.138 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -77.81 -24.01 48.9 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.299 -1.0 . . . . 71.11 108.299 170.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.528 ' HD1' ' HG2' ' A' ' 82' ' ' ARG . 83.8 m-85 -104.23 171.79 7.15 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.624 1.17 . . . . 74.55 109.461 167.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.649 ' SG ' HG21 ' A' ' 85' ' ' ILE . 57.9 m 53.01 49.92 19.1 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 124.093 0.87 . . . . 61.5 110.936 -175.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 51.1 pttt -61.5 -49.68 75.78 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 113.726 -1.579 . . . . 75.52 111.904 -174.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.584 ' HB3' ' HB2' ' A' ' 140' ' ' ASP . 28.6 mmtp -67.31 -45.26 77.05 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.544 0.337 . . . . 73.35 111.648 -174.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.82 -33.14 75.16 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.114 0.565 . . . . 74.4 110.999 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.62 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 21.5 t -75.72 -38.51 58.5 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.938 0.895 . . . . 72.41 111.849 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 25' ' ' LYS . 50.9 mtp85 -66.86 -41.8 86.75 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.798 -0.445 . . . . 73.14 109.798 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.402 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 32.3 ttp85 -63.04 -47.83 81.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.32 -0.854 . . . . 74.21 110.84 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.508 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.2 tp -55.08 -57.73 10.52 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.677 0.61 . . . . 74.55 110.776 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -42.95 98.46 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.061 0.85 . . . . 71.33 113.571 -177.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -60.02 -46.39 89.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.314 0.646 . . . . 65.25 111.514 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.497 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 70.2 mtt-85 -61.55 -53.83 51.16 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.837 0.71 . . . . 75.42 110.333 178.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.493 HG23 HG22 ' A' ' 14' ' ' ILE . 77.1 t -53.62 -43.54 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 124.168 0.918 . . . . 74.24 111.415 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.486 HD23 HD12 ' A' ' 39' ' ' ILE . 72.5 mt -63.4 -46.16 87.69 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 123.695 0.622 . . . . 72.24 111.147 177.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.94 -22.81 65.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.084 -0.507 . . . . 55.01 113.31 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.562 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 36.6 mt -87.0 -42.55 13.02 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.452 0.701 . . . . 75.24 112.546 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.486 HD12 HD23 ' A' ' 36' ' ' LEU . 18.7 pt -80.94 -40.14 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 112.096 0.406 . . . . 74.31 112.096 -172.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -57.55 -44.04 99.29 Favored Pre-proline 0 N--CA 1.486 1.374 0 N-CA-C 114.257 1.206 . . . . 74.34 114.257 -173.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.599 ' HA ' ' HE2' ' A' ' 44' ' ' MET . 13.5 Cg_endo -55.94 -31.84 83.32 Favored 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 122.325 2.016 . . . . 65.35 112.609 174.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.416 HD13 HD21 ' A' ' 45' ' ' LEU . 3.3 mm? -83.25 -29.87 28.1 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.044 -0.526 . . . . 73.44 110.383 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.54 -31.84 72.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.985 0.514 . . . . 64.11 110.837 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.599 ' HE2' ' HA ' ' A' ' 41' ' ' PRO . 72.5 mtm -65.89 -45.84 80.55 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 123.423 0.452 . . . . 72.55 111.556 178.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.416 HD21 HD13 ' A' ' 42' ' ' LEU . 4.3 pp -76.35 -26.97 56.27 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.277 0.231 . . . . 75.24 111.167 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -64.3 -42.49 96.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.121 0.969 . . . . 72.13 109.704 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 N--CA 1.475 0.824 0 CA-C-N 114.475 -1.239 . . . . 74.12 110.599 175.603 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 CA--C 1.55 0.943 0 N-CA-C 110.0 -0.37 . . . . 64.44 110.0 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -54.22 -56.9 13.76 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.389 0.676 . . . . 72.32 110.147 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.459 ' HE3' ' HG3' ' A' ' 119' ' ' GLU . 47.0 pttt -68.77 -31.24 70.13 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.278 -0.874 . . . . 74.14 112.639 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.408 HD23 HD11 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -65.88 -55.74 15.44 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 108.702 -0.851 . . . . 71.23 108.702 -178.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 m -67.5 -36.05 80.33 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.2 -0.909 . . . . 75.24 111.372 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 100.0 m -62.31 -45.99 90.74 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 123.266 0.354 . . . . 74.32 110.962 177.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.78 94.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 123.571 0.544 . . . . 63.01 110.459 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.622 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 24.8 mmt -68.38 -25.97 65.33 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-N 115.588 -0.733 . . . . 64.11 112.252 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -75.7 -45.65 35.63 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.788 0.835 . . . . 73.42 110.269 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -62.88 -42.42 99.76 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.261 1.025 . . . . 71.1 110.245 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.562 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 6.3 t80 -67.03 -52.57 40.79 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 114.903 -1.044 . . . . 74.14 109.297 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.61 -47.12 63.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.41 1.084 . . . . 73.43 110.635 177.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.3 90.77 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.982 0.801 . . . . 72.54 111.486 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.469 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -65.19 -38.37 90.27 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.832 0.853 . . . . 74.43 111.512 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -63.37 -35.16 79.47 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.829 0.852 . . . . 75.4 111.046 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -68.69 -38.78 80.59 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.86 0.464 . . . . 74.22 111.171 175.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -59.24 -49.32 78.29 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 123.478 0.486 . . . . 74.14 109.954 176.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.74 -52.16 66.66 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.222 0.951 . . . . 72.21 111.634 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.44 -45.61 80.7 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.582 1.153 . . . . 73.12 111.758 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.38 -38.83 91.49 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.81 -1.086 . . . . 53.24 112.874 -176.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -76.84 -37.26 55.97 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.221 -0.895 . . . . 62.12 112.183 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.457 HG21 ' CZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -65.38 -32.53 58.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.492 1.042 . . . . 65.22 110.505 171.297 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.66 -47.5 84.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.323 -0.621 . . . . 63.4 109.323 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -71.6 -27.94 63.47 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.085 0.554 . . . . 64.43 112.248 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.77 4.51 36.58 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.743 0.817 . . . . 74.32 111.886 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.7 p -58.96 -26.44 64.43 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.019 0.438 . . . . 52.13 111.201 175.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -79.23 108.15 12.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.274 -1.01 . . . . 75.44 108.274 165.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.528 ' HG2' ' HD1' ' A' ' 23' ' ' TYR . 2.3 mpt_? -71.34 -24.08 62.04 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.28 0.632 . . . . 75.03 109.924 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.9 m -67.43 -35.74 79.85 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.724 0.81 . . . . 74.2 111.246 172.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.85 -41.0 99.18 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.051 0.94 . . . . 73.14 110.067 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 24' ' ' CYS . 46.8 mt -59.73 -59.08 4.49 Favored 'Isoleucine or valine' 0 C--N 1.352 0.715 0 CA-C-N 114.754 -1.112 . . . . 75.52 109.671 175.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.46 -33.48 65.95 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.176 0.59 . . . . 74.41 111.999 -178.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -60.04 -53.66 55.23 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.36 1.064 . . . . 72.13 111.258 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -77.96 -26.79 48.99 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 122.306 -0.246 . . . . 71.13 110.458 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.545 ' HG ' ' HG2' ' A' ' 145' ' ' ARG . 10.5 tp -72.7 -36.51 67.86 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.811 0.844 . . . . 75.33 110.951 -169.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.7 t -67.53 -30.67 70.38 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.664 -0.698 . . . . 74.54 110.605 175.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.25 -3.48 57.78 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.142 0.977 . . . . 51.12 110.936 177.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.473 0.702 0 C-N-CA 124.095 0.958 . . . . 73.3 110.485 177.88 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.573 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 22.2 mm . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 108.464 -0.939 . . . . 73.45 108.464 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -36.99 -54.17 0.95 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 125.714 1.606 . . . . 73.23 112.232 -178.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.457 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 52.9 m-85 -128.49 42.37 3.33 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 114.97 -1.014 . . . . 74.32 112.006 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.573 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 4.9 tmtm? -58.58 -61.1 2.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 119.512 1.051 . . . . 71.24 109.916 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.83 -41.03 92.29 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.287 -0.869 . . . . 73.34 111.626 -174.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.7 t -67.86 -43.63 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 123.513 0.508 . . . . 72.35 110.851 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -61.41 -38.88 88.72 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.563 -0.744 . . . . 74.51 110.269 174.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -31.89 72.8 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.033 0.533 . . . . 73.21 109.801 177.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.81 -56.68 10.63 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.154 0.582 . . . . 75.44 109.878 174.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.469 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.8 mp -55.3 -38.87 69.22 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.688 0.618 . . . . 74.24 111.008 178.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.2 t -73.66 -49.07 27.75 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.527 0.731 . . . . 75.01 111.888 -174.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.41 -48.59 74.83 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.44 0.696 . . . . 74.02 109.674 -177.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.1 t -64.52 -37.12 79.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 CA-C-N 114.968 -1.015 . . . . 74.52 110.516 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.414 ' HZ3' HD21 ' A' ' 42' ' ' LEU . 61.2 t-105 -60.97 -38.65 86.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.56 0.344 . . . . 75.44 111.497 176.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.0 -56.9 16.3 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.118 -0.697 . . . . 74.4 109.118 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -55.27 -44.69 75.84 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.199 0.937 . . . . 75.21 111.16 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.432 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.4 tt -69.82 -53.4 18.38 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.29 1.436 . . . . 74.43 110.796 -171.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.5 t -63.64 -36.02 82.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.371 0.668 . . . . 65.4 110.998 -179.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.54 -53.54 54.96 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.563 0.539 . . . . 72.33 111.155 176.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.408 HD11 HD23 ' A' ' 58' ' ' LEU . 3.9 pp -70.05 -24.42 63.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.089 -0.382 . . . . 72.41 111.796 -177.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.41 HD13 ' HE3' ' A' ' 122' ' ' MET . 67.3 mt -70.17 -43.14 71.45 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.297 0.239 . . . . 64.11 111.149 173.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.54 -23.06 40.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.509 0.559 . . . . 71.22 112.509 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.96 -50.13 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.407 0.283 . . . . 71.41 111.203 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.459 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 24.8 mm-40 -81.34 -56.76 3.84 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.924 0.392 . . . . 74.21 110.883 -176.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -86.72 -1.36 57.66 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 115.647 -0.706 . . . . 74.12 110.83 -175.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.7 mmt180 65.52 19.01 11.46 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.173 1.389 . . . . 74.42 113.331 170.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.41 ' HE3' HD13 ' A' ' 116' ' ' LEU . 50.9 mtp -70.64 143.05 89.37 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.708 0.803 . . . . 71.53 112.01 -173.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo . . . . . 0 C--N 1.37 1.676 0 C-N-CA 122.464 2.109 . . . . 74.52 113.194 179.558 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.8 m0 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 113.307 0.854 . . . . 73.23 113.307 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.91 -41.35 19.01 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.149 0.5 . . . . 65.44 110.69 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -80.78 -23.76 39.08 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.134 0.79 . . . . 72.14 113.134 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.402 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 76.8 mt-10 -62.29 -53.69 51.47 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.477 0.486 . . . . 73.5 109.732 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.97 -61.82 1.86 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.95 1.406 . . . . 75.32 111.563 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.54 -41.04 93.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 123.529 0.518 . . . . 74.45 112.304 -179.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 34.1 tt0 -67.87 -63.29 1.09 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 118.035 0.379 . . . . 61.32 111.746 -175.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.584 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 2.6 p30 -73.4 -30.58 63.36 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.276 -0.392 . . . . 72.21 111.623 -171.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.405 ' HB1' HD12 ' A' ' 96' ' ' ILE . . . -77.55 -23.06 50.18 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-O 119.117 -0.468 . . . . 71.35 111.453 176.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -60.51 -51.95 67.27 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.588 -0.893 . . . . 74.52 108.588 164.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 36.9 mt-10 -59.44 -40.47 86.9 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 124.085 0.865 . . . . 73.13 111.528 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.493 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 14.2 t0 -79.75 -45.97 17.87 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.16 0.984 . . . . 72.01 110.962 -168.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.545 ' HG2' ' HG ' ' A' ' 89' ' ' LEU . 4.3 tmt_? -62.73 -42.98 99.93 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.191 0.997 . . . . 72.54 109.158 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -67.45 -34.24 76.79 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.626 -0.716 . . . . 75.13 111.027 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.25 -24.9 54.55 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.525 0.33 . . . . 75.24 111.847 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.06 -36.75 35.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.845 0.458 . . . . 74.53 110.043 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -80.51 -41.18 24.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.092 0.557 . . . . 74.23 112.042 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' MET . . . . . 0.483 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 3.4 tpt -102.54 55.97 0.78 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 107.076 -1.453 . . . . 74.41 107.076 176.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.3 tp . . . . . 0 N--CA 1.469 0.513 0 CA-C-N 114.052 -1.431 . . . . 75.53 111.156 -168.553 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 110.238 -0.282 . . . . 74.34 110.238 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -59.09 -51.51 69.73 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.789 -0.449 . . . . 73.03 109.789 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.61 -36.7 81.49 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 124.063 0.852 . . . . 71.14 111.375 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -57.53 -47.63 81.48 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 123.532 0.52 . . . . 73.33 109.784 176.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.98 -47.99 78.21 Favored 'General case' 0 C--O 1.212 -0.915 0 O-C-N 123.886 0.741 . . . . 75.23 110.977 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.13 -49.37 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 123.999 0.92 . . . . 73.33 111.313 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.3 mm -71.31 -43.81 73.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 CA-C-N 115.141 -0.936 . . . . 73.15 111.049 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -62.49 -51.19 68.43 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 122.874 0.469 . . . . 70.14 109.987 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -54.33 -46.48 72.89 Favored 'General case' 0 C--O 1.208 -1.116 0 O-C-N 124.453 1.095 . . . . 75.33 110.548 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.44 -52.95 49.77 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 124.332 1.02 . . . . 64.23 113.828 -177.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.405 ' HG3' HD13 ' A' ' 39' ' ' ILE . 27.3 mt-30 -66.25 -40.72 90.4 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 122.842 0.457 . . . . 70.03 111.2 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.44 -37.75 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.885 0.874 . . . . 73.11 110.427 174.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.5 HD13 ' O ' ' A' ' 69' ' ' LEU . 17.0 mt -59.24 -50.8 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.663 1.185 . . . . 71.53 109.804 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -56.97 -43.86 82.04 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.354 1.034 . . . . 75.2 111.286 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.69 -49.41 71.01 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.033 0.533 . . . . 73.04 112.141 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.534 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 10.4 ptm180 -81.8 -16.44 50.92 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.495 0.554 . . . . 74.12 112.495 -174.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.644 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 38.5 t -69.03 -19.84 64.12 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.515 0.726 . . . . 75.15 110.775 173.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.615 ' HA ' ' HG ' ' A' ' 28' ' ' CYS . 40.1 mt-10 -72.13 1.93 6.66 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.48 0.712 . . . . 74.34 112.154 175.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -65.95 -32.1 73.39 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.246 0.618 . . . . 61.52 111.064 165.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.46 ' SD ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -71.4 86.04 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.824 0.449 . . . . 74.1 110.897 -176.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -71.31 -47.4 56.93 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 106.7 -1.593 . . . . 72.33 106.7 170.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.426 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.8 m-85 -91.53 142.98 27.06 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.358 -1.349 . . . . 71.41 107.358 164.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 85' ' ' ILE . 38.9 m 63.34 46.05 4.63 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 124.248 0.967 . . . . 75.01 110.247 -160.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' O ' ' HB3' ' A' ' 28' ' ' CYS . 56.9 pttt -70.07 -44.29 69.42 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.78 -1.555 . . . . 74.3 111.511 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.721 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 45.1 mtpt -74.22 -26.87 60.5 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 119.178 -0.439 . . . . 75.05 109.83 -178.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -31.22 71.83 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.649 0.593 . . . . 72.44 109.969 171.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.644 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 9.0 t -67.18 -43.63 81.72 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.638 0.775 . . . . 72.23 111.432 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -76.39 -24.84 54.09 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-O 119.84 -0.124 . . . . 73.53 111.027 176.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 4.1 tpm_? -65.09 -59.08 4.52 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.547 -0.909 . . . . 74.34 108.547 176.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 ' SG ' ' A' ' 18' ' ' CYS . 58.3 tp -61.5 -47.42 85.72 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 124.731 1.27 . . . . 72.13 110.615 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.59 -54.74 34.59 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 124.076 0.86 . . . . 72.41 113.67 -174.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -67.01 -32.51 73.79 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.323 0.649 . . . . 73.31 110.617 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' ARG . 1.7 mtt-85 -56.3 -56.93 14.97 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 123.858 0.724 . . . . 75.43 110.645 173.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.97 -43.22 95.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 CA-C-N 114.156 -1.384 . . . . 74.41 110.559 -175.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.47 -50.42 74.01 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.865 0.466 . . . . 72.44 110.939 177.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.34 -18.63 69.71 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 115.379 -0.828 . . . . 73.44 113.557 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.9 -52.56 5.92 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.771 0.828 . . . . 74.15 110.259 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.405 HD13 ' HG3' ' A' ' 12' ' ' GLN . 16.2 pt -75.89 -32.84 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 118.761 -0.638 . . . . 75.42 111.977 -167.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.467 ' O ' ' HG2' ' A' ' 44' ' ' MET . 92.7 mttt -58.15 -49.56 92.91 Favored Pre-proline 0 CA--C 1.561 1.401 0 CA-C-O 117.609 -1.186 . . . . 72.14 112.506 -178.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -45.65 -43.37 18.53 Favored 'Trans proline' 0 C--N 1.401 3.306 0 C-N-CA 122.932 2.421 . . . . 73.23 113.485 169.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -71.05 -38.72 72.53 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.653 0.381 . . . . 73.34 111.19 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 47.7 mt-10 -67.42 -20.89 65.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.794 0.438 . . . . 75.13 111.085 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.467 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 28.3 mmt -68.55 -55.8 10.46 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 110.008 -0.367 . . . . 74.55 110.008 173.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.648 HD21 ' SD ' ' A' ' 122' ' ' MET . 2.6 pp -70.25 -21.49 62.98 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 111.623 0.231 . . . . 74.25 111.623 179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.3 tm0? -80.44 -33.33 36.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.014 0.926 . . . . 44.52 110.35 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 109.597 -0.52 . . . . 72.01 109.597 178.212 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.4 p . . . . . 0 N--CA 1.477 0.886 0 CA-C-O 119.039 -0.505 . . . . 62.41 109.833 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -52.8 -46.53 67.69 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.439 0.696 . . . . 74.01 112.549 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -64.07 -39.49 94.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.737 0.815 . . . . 73.04 111.568 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.97 -35.55 64.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.11 0.964 . . . . 74.22 110.423 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 m -66.54 -49.69 65.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.942 0.897 . . . . 65.34 109.077 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 32.3 m -61.04 -38.31 85.69 Favored 'General case' 0 C--N 1.356 0.862 0 O-C-N 124.06 0.85 . . . . 73.01 110.482 178.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.454 ' HB2' HD12 ' A' ' 112' ' ' LEU . . . -65.4 -45.65 83.15 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 123.565 0.746 . . . . 74.02 110.611 -179.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.3 mmt -70.17 -24.96 63.23 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 123.821 0.701 . . . . 74.22 111.666 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -71.79 -46.23 58.98 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.218 0.607 . . . . 73.3 110.173 174.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.3 mtt180 -62.44 -38.25 89.02 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.753 0.821 . . . . 73.11 110.311 175.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.1 t80 -63.32 -59.71 4.35 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 113.704 -1.589 . . . . 74.42 109.192 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.429 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 25.2 ttpp -56.17 -44.12 79.04 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 124.561 1.163 . . . . 74.14 110.697 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.28 82.65 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 124.258 0.974 . . . . 73.4 112.142 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.473 ' HB2' HD13 ' A' ' 105' ' ' LEU . . . -68.86 -39.19 79.99 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.511 0.725 . . . . 72.23 111.418 178.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.5 ' O ' HD13 ' A' ' 14' ' ' ILE . 4.2 mm? -68.53 -31.18 70.24 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.713 0.805 . . . . 73.44 111.131 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 55.3 mt-10 -67.44 -43.42 81.19 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.646 -0.501 . . . . 75.52 109.646 174.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.72 -38.97 92.81 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.127 -0.942 . . . . 75.25 111.06 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.13 -44.96 86.97 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.413 0.685 . . . . 61.2 110.578 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -59.8 -41.6 91.56 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 124.328 1.017 . . . . 73.31 110.658 176.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.87 -37.09 91.99 Favored Glycine 0 C--N 1.35 1.307 0 CA-C-N 115.438 -0.801 . . . . 73.1 113.107 177.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.58 -52.2 62.04 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 122.832 0.453 . . . . 75.4 110.458 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.44 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -70.61 -20.0 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 N-CA-C 112.616 0.598 . . . . 74.54 112.616 178.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.534 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 3.3 tm-20 -67.32 -43.37 81.8 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.344 -0.613 . . . . 75.4 109.344 170.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -69.38 -40.87 77.17 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.973 0.909 . . . . 73.43 111.416 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 13.9 m-85 -80.8 0.34 35.28 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.078 0.951 . . . . 74.41 112.511 -173.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -56.43 -32.29 64.76 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.368 0.604 . . . . 74.34 109.859 174.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -82.62 112.23 19.31 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 114.858 -1.065 . . . . 72.25 109.441 168.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.411 ' HB3' ' HB2' ' A' ' 23' ' ' TYR . 2.9 mpt_? -74.9 -24.35 58.52 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.775 0.83 . . . . 73.03 110.566 -177.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -67.48 -37.55 83.05 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.078 0.951 . . . . 64.12 111.076 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.55 -46.22 89.51 Favored 'General case' 0 C--O 1.255 1.37 0 C-N-CA 124.098 0.959 . . . . 71.0 110.076 173.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.574 HG21 HD11 ' A' ' 97' ' ' LEU . 34.2 mt -58.31 -56.29 17.08 Favored 'Isoleucine or valine' 0 C--N 1.358 0.942 0 CA-C-N 114.573 -1.194 . . . . 71.0 109.956 177.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.3 t -53.91 -39.92 66.24 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.675 1.19 . . . . 74.21 111.612 -176.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -61.04 -54.1 48.94 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 124.544 1.153 . . . . 75.05 111.026 179.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -22.86 53.42 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 116.306 -0.407 . . . . 71.42 111.051 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.1 tp -80.75 -33.77 34.82 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.099 0.96 . . . . 73.5 110.888 -172.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.7 t -72.75 -20.22 61.23 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 121.125 0.488 . . . . 70.04 109.992 172.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.34 8.9 43.67 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.48 1.112 . . . . 75.14 111.244 174.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.484 1.269 0 C-N-CA 124.612 1.165 . . . . 73.42 109.466 -178.959 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 9.1 mm . . . . . 0 CA--C 1.547 0.828 0 N-CA-C 108.217 -1.031 . . . . 75.32 108.217 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.574 HD11 HG21 ' A' ' 85' ' ' ILE . 4.5 tp -58.13 -30.51 66.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.928 0.714 . . . . 72.34 112.928 -168.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -119.63 17.88 12.76 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-O 118.159 -0.924 . . . . 74.33 110.645 -176.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.462 ' HD3' ' N ' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -36.3 -53.32 0.83 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 115.024 1.491 . . . . 75.41 115.024 -160.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . 0.462 ' N ' ' HD3' ' A' ' 99' ' ' LYS . 30.6 m-20 -71.3 -50.75 29.34 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 118.648 0.658 . . . . 73.14 111.564 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.92 -52.82 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 123.944 0.898 . . . . 73.44 111.18 -176.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -63.78 -36.88 85.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.334 1.054 . . . . 75.34 110.998 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -62.71 -32.26 73.33 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.197 0.599 . . . . 64.14 110.717 172.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 98.9 mttt -70.99 -39.74 72.27 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 119.348 -0.358 . . . . 73.11 110.214 174.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 68' ' ' ALA . 10.4 mp -58.2 -44.61 88.18 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.603 -0.517 . . . . 73.54 109.603 172.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.4 m -63.11 -50.42 70.57 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.015 0.926 . . . . 71.42 111.347 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 37.6 t70 -73.56 -44.05 58.35 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 115.128 -0.942 . . . . 74.44 111.184 -171.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.505 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 93.8 t -64.06 -36.48 77.0 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 118.843 -0.598 . . . . 73.5 109.416 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -64.21 -44.71 91.08 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 119.088 -0.482 . . . . 74.14 112.055 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -64.78 -44.31 90.42 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 118.568 0.622 . . . . 63.22 110.378 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 11.9 mm-40 -60.8 -41.04 94.86 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.044 0.449 . . . . 61.4 111.076 176.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.6 tp -61.57 -59.96 4.42 Favored 'General case' 0 C--O 1.215 -0.726 0 C-N-CA 124.633 1.173 . . . . 73.45 107.941 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.511 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 33.0 t -55.82 -41.22 73.88 Favored 'General case' 0 C--N 1.35 0.601 0 O-C-N 124.557 1.16 . . . . 70.52 111.402 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 81.0 mt -57.7 -54.88 41.87 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.886 0.741 . . . . 71.33 111.481 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.21 -23.74 63.93 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 122.497 -0.127 . . . . 71.35 111.185 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.604 HD12 ' SD ' ' A' ' 122' ' ' MET . 95.8 mt -73.86 -28.38 61.55 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.769 0.828 . . . . 74.42 111.038 174.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 113' ' ' SER . 27.6 mm-40 -71.94 -43.67 64.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.025 0.53 . . . . 74.42 109.639 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.84 -50.07 26.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 116.036 -0.529 . . . . 64.32 112.046 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . 0.402 ' HB2' ' OE1' ' A' ' 120' ' ' GLN . 8.6 mm-40 -82.61 -57.61 3.26 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 111.936 0.347 . . . . 75.3 111.936 -171.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.402 ' OE1' ' HB2' ' A' ' 119' ' ' GLU . 24.5 mp0 -89.14 -29.85 19.04 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.519 0.328 . . . . 73.23 111.559 -176.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 56.39 61.84 2.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.465 1.106 . . . . 71.12 110.92 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.648 ' SD ' HD21 ' A' ' 45' ' ' LEU . 22.4 ptm -91.32 147.17 34.88 Favored Pre-proline 0 N--CA 1.476 0.843 0 CA-C-N 114.569 -1.196 . . . . 73.31 108.109 172.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo . . . . . 0 C--N 1.374 1.88 0 C-N-CA 122.225 1.95 . . . . 75.41 113.264 -174.73 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 27.4 m0 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 113.141 0.793 . . . . 71.22 113.141 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.43 -27.89 40.17 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.056 0.762 . . . . 71.11 113.056 -174.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -88.13 -43.25 11.8 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.121 0.569 . . . . 73.14 110.638 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.401 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 45.3 mt-10 -59.59 -34.69 73.06 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.2 1.0 . . . . 73.3 112.778 -177.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 55.8 m-20 -61.25 -64.39 0.97 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.338 0.655 . . . . 73.21 109.885 -176.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -61.45 -43.98 97.91 Favored 'General case' 0 C--O 1.213 -0.824 0 O-C-N 124.059 0.849 . . . . 64.45 110.864 -178.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.9 tm0? -64.88 -60.22 3.32 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.399 0.68 . . . . 73.41 110.878 -171.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -67.46 -43.91 79.92 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-N 114.906 -1.043 . . . . 71.41 111.023 -173.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.88 -32.35 72.78 Favored 'General case' 0 C--N 1.358 0.955 0 CA-C-N 116.103 -0.499 . . . . 43.53 111.945 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . 0.468 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 31.2 t70 -65.8 -47.63 74.45 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.541 0.526 . . . . 71.14 110.569 176.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -58.51 -41.41 85.34 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 124.108 0.88 . . . . 73.42 111.18 177.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.4 t0 -64.96 -42.81 94.26 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.762 0.825 . . . . 64.41 111.724 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -62.36 -37.56 86.15 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.331 -0.849 . . . . 75.42 109.743 175.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 97.9 mtt180 -62.63 -43.07 99.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.837 0.455 . . . . 75.04 109.926 174.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.61 -22.13 62.57 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.018 0.824 . . . . 73.41 111.91 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.2 OUTLIER -81.72 -55.64 4.51 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 122.981 0.512 . . . . 75.54 110.022 176.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -69.32 -61.38 1.81 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.524 -0.762 . . . . 75.23 110.026 -175.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.3 ttm -86.06 72.14 10.47 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.269 -1.382 . . . . 74.5 107.269 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 CA--C 1.539 0.528 0 CA-C-N 115.373 -0.831 . . . . 73.13 109.668 -178.148 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 113.836 1.05 . . . . 74.0 113.836 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -61.33 -40.0 92.6 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.821 0.448 . . . . 74.2 112.08 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.554 HD21 HD13 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -68.8 -38.18 79.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.284 0.564 . . . . 72.11 109.66 -177.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -68.61 -34.48 75.85 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.081 0.952 . . . . 73.45 108.932 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -66.31 -37.94 86.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.93 0.492 . . . . 74.3 110.426 177.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 85.9 mt -57.21 -50.59 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.781 0.832 . . . . 74.13 110.52 171.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.581 HG23 ' HG2' ' A' ' 43' ' ' GLU . 19.5 mm -63.25 -42.85 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 115.668 -0.696 . . . . 72.04 111.305 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -63.53 -51.79 63.97 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 123.848 0.859 . . . . 74.45 110.471 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.438 HD12 ' HE2' ' A' ' 66' ' ' LYS . 82.4 mt -59.22 -53.0 63.28 Favored 'General case' 0 C--O 1.216 -0.699 0 O-C-N 124.04 0.838 . . . . 73.1 110.49 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.443 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.53 -38.62 88.26 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 124.64 1.212 . . . . 73.23 113.9 -177.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -74.4 -43.68 55.3 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 122.536 -0.39 . . . . 74.53 110.666 -179.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.84 -24.32 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.546 0.339 . . . . 74.32 110.353 175.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.487 HG23 HG23 ' A' ' 35' ' ' VAL . 51.3 mt -64.43 -52.9 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.729 0.812 . . . . 72.3 108.913 171.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -54.34 -36.8 64.19 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 124.234 0.959 . . . . 73.42 111.25 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -72.04 -66.0 0.7 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.828 0.851 . . . . 75.51 111.34 178.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.432 ' HD2' HG13 ' A' ' 76' ' ' ILE . 9.7 ptp180 -68.34 -19.31 64.64 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.732 0.813 . . . . 75.3 112.564 -170.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.9 t -64.59 -29.85 70.87 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.751 0.42 . . . . 71.53 110.874 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.44 -6.43 24.74 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.522 0.564 . . . . 74.44 112.522 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.81 -28.43 69.86 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 119.424 -0.322 . . . . 74.51 110.797 169.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.502 ' HE3' HG22 ' A' ' 76' ' ' ILE . 3.2 mmt -65.66 94.57 0.2 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.982 -0.748 . . . . 72.32 108.982 176.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -72.88 -26.69 61.53 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.816 0.817 . . . . 74.51 110.123 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -93.88 -174.25 3.38 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.413 -1.721 . . . . 74.25 109.265 166.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.466 ' SG ' HG21 ' A' ' 85' ' ' ILE . 56.8 m 54.32 53.9 10.24 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.814 0.845 . . . . 73.22 112.8 174.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.0 -52.45 65.48 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.963 0.905 . . . . 73.33 112.14 -175.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 19.3 tptm -68.19 -47.83 66.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.279 -0.873 . . . . 75.15 110.993 -173.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.474 ' HA ' ' HB3' ' A' ' 30' ' ' ARG . 19.1 mt-30 -73.02 -25.48 60.97 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.788 0.662 . . . . 75.2 112.788 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 42.4 t -71.19 -49.44 43.67 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.99 0.516 . . . . 75.1 110.271 176.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -73.35 -22.0 60.4 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.425 -0.807 . . . . 74.42 111.053 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.799 HH12 ' HB2' ' A' ' 98' ' ' PHE . 19.1 ttt-85 -63.12 -52.93 60.6 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.314 1.046 . . . . 75.54 110.043 169.449 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.87 -49.42 77.82 Favored 'General case' 0 C--N 1.359 1.011 0 O-C-N 123.843 0.714 . . . . 74.14 109.705 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.14 96.6 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 124.301 1.001 . . . . 63.2 112.895 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -63.12 -49.12 75.68 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.879 0.872 . . . . 73.42 111.019 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 84.1 mtt-85 -61.56 -56.37 20.72 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.053 0.846 . . . . 73.04 110.716 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.487 HG23 HG23 ' A' ' 14' ' ' ILE . 58.6 t -56.23 -46.44 81.38 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 O-C-N 124.296 0.997 . . . . 73.31 111.407 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.495 HD22 HD13 ' A' ' 39' ' ' ILE . 72.3 mt -62.77 -40.98 98.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 123.443 0.465 . . . . 73.33 111.25 177.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.29 -27.56 71.78 Favored Glycine 0 CA--C 1.532 1.114 0 O-C-N 123.379 0.425 . . . . 75.42 112.951 177.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.57 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 47.9 mt -84.52 -47.75 10.28 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.305 0.642 . . . . 74.35 111.481 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.495 HD13 HD22 ' A' ' 36' ' ' LEU . 22.4 pt -76.83 -40.28 31.64 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.357 0 CA-C-O 117.807 -1.092 . . . . 73.53 111.409 -171.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -54.39 -47.79 96.61 Favored Pre-proline 0 N--CA 1.493 1.675 0 N-CA-C 113.553 0.946 . . . . 75.15 113.553 -169.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.38 -48.01 23.81 Favored 'Trans proline' 0 C--N 1.401 3.315 0 C-N-CA 122.003 1.802 . . . . 73.33 111.395 171.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.554 HD13 HD21 ' A' ' 4' ' ' LEU . 4.3 mm? -69.89 -25.23 63.6 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 124.087 0.867 . . . . 73.41 111.474 -177.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.581 ' HG2' HG23 ' A' ' 8' ' ' ILE . 43.4 mt-10 -67.22 -52.08 45.49 Favored 'General case' 0 C--N 1.354 0.783 0 N-CA-C 108.544 -0.91 . . . . 73.22 108.544 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 70.6 mtm -57.63 -45.85 84.9 Favored 'General case' 0 C--N 1.351 0.668 0 O-C-N 124.211 0.944 . . . . 74.21 110.306 177.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.4 HD12 ' HE3' ' A' ' 122' ' ' MET . 79.9 mt -71.62 -21.57 61.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.732 0.813 . . . . 65.31 112.607 -178.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.65 -53.11 7.95 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.581 0.753 . . . . 72.4 109.807 178.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 . . . . . 0 N--CA 1.482 1.17 0 O-C-N 123.681 0.613 . . . . 54.14 111.361 -179.091 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 109.91 -0.404 . . . . 74.12 109.91 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -59.94 -50.7 72.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.967 0.507 . . . . 75.34 110.741 -175.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.84 67.13 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.637 -0.71 . . . . 71.23 112.051 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 33.4 tp -66.72 -48.89 67.77 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.903 0.481 . . . . 74.34 110.047 177.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.8 m -60.52 -43.36 97.18 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 124.189 0.931 . . . . 74.41 110.136 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -56.46 -47.65 78.71 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 123.793 0.683 . . . . 74.34 110.959 176.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.44 98.77 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.373 0.669 . . . . 72.44 111.439 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.471 ' SD ' HD12 ' A' ' 112' ' ' LEU . 23.1 mmt -64.71 -34.09 77.49 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.292 0.637 . . . . 75.43 111.266 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -73.72 -35.29 65.09 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.218 0.607 . . . . 71.35 110.653 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -66.06 -39.58 90.21 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.688 0.795 . . . . 65.4 110.27 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.57 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 3.3 t80 -70.76 -42.45 70.43 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.188 0.995 . . . . 73.21 110.234 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.438 ' HE2' HD12 ' A' ' 10' ' ' LEU . 14.7 tmtt? -64.72 -38.92 92.63 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.48 1.112 . . . . 75.2 110.053 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.8 -40.6 92.05 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.381 0.673 . . . . 74.32 111.009 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.67 80.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.385 0.674 . . . . 73.23 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -72.09 -26.09 62.01 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.786 -0.643 . . . . 75.1 111.067 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.72 -34.37 71.84 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.906 0.482 . . . . 75.33 110.351 172.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.487 ' HB3' HG23 ' A' ' 101' ' ' VAL . 25.3 mm-40 -64.13 -44.46 92.14 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.985 -0.552 . . . . 65.12 110.878 175.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -63.29 -59.72 4.34 Favored 'General case' 0 C--N 1.354 0.796 0 O-C-N 123.454 0.471 . . . . 62.21 110.555 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -47.64 -46.35 28.8 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.019 1.728 . . . . 74.1 111.875 -176.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.2 -44.05 87.59 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.471 1.107 . . . . 73.23 113.416 -176.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.468 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . 25.4 mt-10 -67.06 -48.36 68.49 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 118.294 -0.86 . . . . 74.55 111.028 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.617 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.8 pt -66.37 -26.77 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 CA-C-N 118.704 0.684 . . . . 75.31 111.678 176.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -60.77 -40.96 94.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.11 0.564 . . . . 72.04 110.232 171.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -85.39 -22.65 28.29 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.874 0.694 . . . . 74.24 112.874 175.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.617 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.2 m-85 -79.33 -1.63 37.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.549 0.74 . . . . 71.35 111.68 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.4 p -56.74 -26.33 56.91 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.424 0.689 . . . . 75.34 110.775 172.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -82.73 112.4 19.55 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 107.548 -1.278 . . . . 75.32 107.548 162.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.431 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.7 mpt_? -70.78 -23.69 62.44 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.069 0.548 . . . . 63.53 110.821 -175.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 25.5 m -63.73 -33.97 76.85 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.158 0.983 . . . . 61.01 111.66 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -57.09 -45.82 83.04 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.157 0.983 . . . . 51.53 110.075 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.499 HD11 ' SD ' ' A' ' 21' ' ' MET . 21.1 mt -60.79 -54.82 29.99 Favored 'Isoleucine or valine' 0 C--N 1.352 0.694 0 O-C-N 124.248 0.967 . . . . 75.34 109.869 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 27.5 t -57.18 -38.03 73.01 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.585 0.553 . . . . 74.31 111.678 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -63.18 -47.93 80.53 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 124.184 0.927 . . . . 74.53 111.243 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.95 -29.88 50.09 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 110.096 -0.335 . . . . 73.42 110.096 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.455 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 11.7 tp -69.04 -39.05 79.42 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.934 0.894 . . . . 73.13 110.254 -172.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -78.01 -27.59 48.97 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.346 0.659 . . . . 53.12 110.84 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.72 -55.39 4.86 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.519 0.728 . . . . 74.14 111.189 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 108.834 -0.802 . . . . 75.41 108.834 175.1 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.467 HG23 ' HB1' ' A' ' 141' ' ' ALA . 3.3 mm . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 106.531 -1.655 . . . . 75.43 106.531 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.9 -48.25 2.29 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.158 0.983 . . . . 75.34 111.925 -173.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.799 ' HB2' HH12 ' A' ' 30' ' ' ARG . 72.7 m-85 -128.42 47.44 2.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.06 0.944 . . . . 70.45 111.256 176.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.1 -62.13 1.85 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 124.418 1.087 . . . . 71.32 111.571 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.07 -42.55 96.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.174 -1.375 . . . . 71.15 110.76 -175.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.487 HG23 ' HB3' ' A' ' 71' ' ' GLU . 61.3 t -63.21 -41.72 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 114.829 -1.078 . . . . 74.51 111.498 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -71.65 -32.94 68.47 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.351 0.66 . . . . 71.5 110.578 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -63.4 -41.38 98.75 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 108.904 -0.776 . . . . 73.13 108.904 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 60.3 mttm -63.37 -49.1 75.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.575 -0.739 . . . . 74.31 110.683 174.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.81 -42.21 97.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.938 0.895 . . . . 74.42 111.22 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.461 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 37.4 t -71.12 -47.79 55.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.054 0.846 . . . . 54.12 110.198 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.562 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 27.3 t70 -57.82 -57.2 13.81 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 124.051 0.844 . . . . 71.22 110.381 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.1 -38.59 82.85 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 CA-C-N 114.945 -1.025 . . . . 63.21 111.272 -178.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -60.46 -42.06 95.42 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.189 0.45 . . . . 74.11 111.221 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtmt -58.91 -57.0 15.01 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 109.665 -0.494 . . . . 75.2 109.665 174.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.66 -44.56 69.76 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.569 0.748 . . . . 74.45 111.784 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.471 HD12 ' SD ' ' A' ' 62' ' ' MET . 9.1 tt -70.21 -55.94 8.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.292 1.437 . . . . 64.04 109.885 -172.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.0 t -61.87 -31.64 71.92 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.836 0.855 . . . . 75.41 111.326 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 51.5 mt -70.24 -51.16 32.83 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 122.963 0.505 . . . . 71.25 111.031 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.87 -24.3 65.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.047 0.385 . . . . 74.43 110.497 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.64 HD22 ' SD ' ' A' ' 122' ' ' MET . 42.2 mt -64.53 -55.51 20.13 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 119.239 -0.41 . . . . 73.53 110.415 172.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -68.77 -32.8 72.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.438 0.533 . . . . 74.02 112.438 -174.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.9 -60.92 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.131 0.572 . . . . 75.24 110.802 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -84.21 -55.93 3.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.251 0.62 . . . . 74.32 111.748 -169.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.46 HE21 ' HA ' ' A' ' 116' ' ' LEU . 2.4 mp0 -82.86 -5.36 58.95 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 122.575 0.35 . . . . 72.23 111.723 -178.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 62.74 25.33 15.05 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.803 1.241 . . . . 75.25 112.344 172.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.64 ' SD ' HD22 ' A' ' 116' ' ' LEU . 69.4 mtp -84.81 126.31 68.66 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.239 1.016 . . . . 75.4 109.998 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo . . . . . 0 C--N 1.374 1.915 0 C-N-CA 123.086 2.524 . . . . 73.44 113.44 -172.747 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 112.381 0.511 . . . . 73.22 112.381 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.3 67.39 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.927 0.491 . . . . 62.5 110.669 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -69.27 -31.22 69.6 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.829 -0.623 . . . . 75.21 111.046 -177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -55.72 -58.56 7.31 Favored 'General case' 0 C--O 1.211 -0.974 0 O-C-N 124.062 0.851 . . . . 62.44 110.407 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.63 -42.51 75.06 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.926 1.084 . . . . 75.4 113.926 -173.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.104 0.253 . . . . 75.44 110.857 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . 0.421 HE21 ' HG3' ' A' ' 143' ' ' GLU . 22.6 tp60 -70.96 -35.43 72.16 Favored 'General case' 0 C--N 1.359 1.0 0 O-C-N 123.099 0.249 . . . . 74.54 110.928 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -64.63 -56.42 13.94 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.986 -0.746 . . . . 61.24 108.986 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.467 ' HB1' HG23 ' A' ' 96' ' ' ILE . . . -58.11 -36.8 73.42 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 124.399 1.062 . . . . 74.43 111.95 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -56.93 -64.09 0.99 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 122.868 0.467 . . . . 73.43 110.155 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . 0.421 ' HG3' HE21 ' A' ' 139' ' ' GLN . 45.5 mt-10 -63.69 -38.41 91.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.979 0.912 . . . . 75.43 111.922 -174.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 18.2 t0 -86.01 -45.19 11.68 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.385 -0.825 . . . . 73.51 111.942 -165.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . 0.455 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 54.4 ttt-85 -65.45 -36.68 84.64 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.406 -0.59 . . . . 64.23 109.406 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 38.5 ttt180 -63.58 -44.45 94.02 Favored 'General case' 0 C--N 1.356 0.887 0 CA-C-N 116.013 -0.539 . . . . 74.32 110.514 173.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.36 -19.53 61.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.261 0.624 . . . . 73.3 112.576 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.434 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.7 OUTLIER -78.21 -60.47 2.36 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 109.138 -0.69 . . . . 64.14 109.138 176.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -70.39 -26.01 63.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.06 -0.973 . . . . 73.23 110.891 -173.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 41.9 ttp -117.31 56.85 0.81 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 107.388 -1.338 . . . . 73.13 107.388 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 59.9 tp . . . . . 0 C--N 1.351 0.673 0 CA-C-N 115.512 -0.767 . . . . 74.2 109.452 174.453 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.339 -0.245 . . . . 74.14 110.339 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -57.3 -51.16 70.51 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 109.432 -0.581 . . . . 73.32 109.432 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.37 -39.82 73.55 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.785 0.834 . . . . 72.54 111.247 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.52 -51.32 69.1 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.462 -0.94 . . . . 75.43 108.462 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -59.37 -52.75 64.27 Favored 'General case' 0 C--O 1.215 -0.725 0 O-C-N 123.788 0.68 . . . . 70.31 110.71 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.407 HG21 HD13 ' A' ' 8' ' ' ILE . 97.7 mt -52.92 -55.01 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.397 1.479 . . . . 73.24 112.365 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.426 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -67.67 -36.88 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 124.046 0.938 . . . . 74.25 110.959 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.6 m -65.75 -46.03 80.36 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.343 0.657 . . . . 62.43 110.411 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.79 -44.44 86.27 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 123.72 0.808 . . . . 73.23 109.736 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.459 ' HA3' HG23 ' A' ' 39' ' ' ILE . . . -60.29 -53.4 45.94 Favored Glycine 0 C--N 1.347 1.164 0 O-C-N 124.251 0.969 . . . . 73.03 113.052 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HG3' HD12 ' A' ' 39' ' ' ILE . 33.5 mt-30 -66.41 -31.95 73.03 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 112.033 0.383 . . . . 74.1 112.033 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -70.36 -36.92 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.331 0.653 . . . . 74.41 110.723 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.3 mt -58.77 -49.24 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.641 0.776 . . . . 74.51 109.056 175.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -56.47 -52.9 62.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.695 -1.139 . . . . 74.32 111.343 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -60.7 -57.61 11.95 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 123.799 0.687 . . . . 73.11 111.053 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -73.58 -17.19 61.21 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 112.683 0.623 . . . . 75.12 112.683 -173.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 45.7 t -60.41 -17.11 41.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.147 0.579 . . . . 71.21 111.578 170.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -55.13 -23.38 20.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.514 0.726 . . . . 74.45 112.175 172.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -66.02 -15.6 63.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.456 0.702 . . . . 64.13 112.036 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.0 mmt -78.14 82.69 4.46 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.858 -0.793 . . . . 75.03 108.858 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -35.45 73.9 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.781 -1.192 . . . . 74.21 107.781 173.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -97.03 177.16 5.7 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.656 -1.156 . . . . 75.1 109.569 165.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.569 ' HG ' HG23 ' A' ' 85' ' ' ILE . 70.9 m 54.53 58.11 5.18 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.772 0.796 . . . . 74.15 109.835 -173.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -70.1 -49.83 46.9 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-N 114.255 -1.339 . . . . 75.4 110.872 -169.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.538 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 24.0 mmtp -61.1 -46.61 89.91 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 108.495 -0.928 . . . . 75.1 108.495 177.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -36.09 71.43 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.343 1.027 . . . . 72.22 113.441 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 40.7 t -70.9 -42.32 70.1 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.405 0.44 . . . . 75.11 110.667 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -71.71 -28.3 63.6 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 115.71 -0.677 . . . . 73.32 110.945 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.687 ' HD2' ' HB3' ' A' ' 136' ' ' GLU . 33.7 ttp180 -82.6 -38.05 24.15 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.489 1.116 . . . . 73.44 109.788 -173.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.2 tp -65.75 -43.39 89.08 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.178 -1.045 . . . . 74.24 108.178 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.93 -35.36 90.37 Favored Glycine 0 C--N 1.351 1.398 0 O-C-N 123.753 0.658 . . . . 63.43 112.745 173.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -64.78 -51.52 61.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.344 0.658 . . . . 74.53 110.742 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.1 mtt-85 -57.6 -59.49 5.11 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.609 -1.178 . . . . 74.11 110.155 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.86 -52.38 61.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 124.668 1.23 . . . . 73.35 112.05 -174.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.28 -45.87 82.69 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 118.046 0.384 . . . . 73.34 110.349 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.41 -24.49 65.79 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 123.258 0.349 . . . . 70.54 113.494 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 42' ' ' LEU . 11.4 tp -86.84 -40.15 15.18 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.577 1.151 . . . . 70.52 112.071 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.459 HG23 ' HA3' ' A' ' 11' ' ' GLY . 15.6 pt -84.6 -33.76 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-O 119.275 -0.393 . . . . 74.03 111.792 -171.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -54.3 -53.76 55.6 Favored Pre-proline 0 N--CA 1.49 1.542 0 CA-C-O 117.992 -1.004 . . . . 74.33 113.131 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.767 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 20.8 Cg_endo -57.68 -38.66 92.5 Favored 'Trans proline' 0 C--N 1.396 3.053 0 C-N-CA 122.218 1.945 . . . . 72.33 112.243 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.5 mm? -66.64 -36.34 82.34 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.609 -0.723 . . . . 72.25 111.296 178.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -73.53 -29.42 62.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.913 0.885 . . . . 75.21 111.666 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.538 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 24.7 mmt -64.9 -33.39 75.91 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.828 0.451 . . . . 75.31 111.336 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.38 -41.5 14.43 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.572 0.349 . . . . 73.33 111.773 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -58.86 -45.82 89.21 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.543 0.737 . . . . 75.42 111.95 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 123.435 0.694 . . . . 73.2 111.167 -171.775 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.2 p . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.197 -0.297 . . . . 71.34 110.197 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -54.21 -51.78 63.34 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.634 0.774 . . . . 74.35 110.85 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -55.85 -38.73 70.45 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.932 0.893 . . . . 71.03 112.351 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 62' ' ' MET . 62.0 tp -67.65 -51.89 44.56 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 124.059 0.944 . . . . 73.12 109.275 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.3 m -61.64 -36.69 81.51 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.281 1.032 . . . . 75.13 111.521 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.8 m -66.67 -47.78 71.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.334 0.654 . . . . 71.11 109.382 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' PHE . . . -56.43 -41.29 76.15 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.722 -0.672 . . . . 75.34 110.178 175.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 58' ' ' LEU . 25.1 mmt -67.25 -28.45 68.05 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.987 0.915 . . . . 72.23 111.934 177.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -70.29 -49.08 53.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.84 0.456 . . . . 74.43 110.767 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -68.19 -33.77 75.06 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 120.529 0.204 . . . . 74.41 110.562 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 1.8 t80 -61.1 -56.25 23.03 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.945 1.298 . . . . 75.11 109.674 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 48.8 tttm -55.77 -50.06 71.46 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.224 -1.353 . . . . 74.15 110.695 175.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.47 -49.86 69.08 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.104 0.961 . . . . 72.43 112.15 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.34 -28.85 64.37 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.412 0.685 . . . . 63.4 111.722 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.4 mt -75.64 -28.18 58.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.718 0.407 . . . . 74.32 111.696 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 51.4 mt-10 -69.92 -42.69 72.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 109.445 -0.576 . . . . 75.05 109.445 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -63.66 -45.38 90.42 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.979 -1.009 . . . . 73.23 110.354 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.6 98.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.278 0.631 . . . . 74.11 111.39 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -57.8 -44.8 86.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.763 1.225 . . . . 71.13 110.265 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -68.23 -32.98 77.03 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 114.764 -1.107 . . . . 64.33 113.209 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -68.0 -51.06 51.53 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 116.915 0.357 . . . . 72.22 110.866 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.479 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.4 OUTLIER -66.44 -28.79 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 118.269 0.486 . . . . 74.42 112.284 175.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -60.74 -41.71 95.93 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.867 -0.79 . . . . 65.21 108.867 172.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -69.25 -39.61 78.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.842 1.257 . . . . 74.41 111.008 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.479 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 18.4 m-85 -81.46 5.45 17.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.996 0.918 . . . . 74.51 112.443 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.9 p -56.7 -32.56 65.59 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.214 0.53 . . . . 65.41 110.199 171.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -86.99 117.56 25.79 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.922 -1.036 . . . . 70.23 109.209 168.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.492 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.4 mpt_? -78.87 -26.17 43.94 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.229 1.012 . . . . 64.13 109.803 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -61.26 -38.65 87.45 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.92 0.888 . . . . 75.24 110.601 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.64 -44.26 96.59 Favored 'General case' 0 C--O 1.257 1.45 0 C-N-CA 124.265 1.026 . . . . 75.42 110.595 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.569 HG23 ' HG ' ' A' ' 24' ' ' CYS . 19.6 mt -60.93 -54.86 29.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 CA-C-N 115.091 -0.958 . . . . 64.11 109.611 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.8 t -54.66 -43.05 72.06 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.556 0.743 . . . . 63.51 111.235 -177.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 49.3 ttm-85 -56.67 -54.98 39.83 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.508 1.13 . . . . 74.12 111.362 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.468 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.18 -26.32 56.07 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.508 -0.314 . . . . 74.21 110.541 -176.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp -71.24 -43.72 66.73 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.077 0.951 . . . . 72.32 110.701 -170.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.6 t -65.08 -19.81 66.17 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.074 -0.966 . . . . 75.45 110.805 177.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.55 -26.97 14.24 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.312 1.045 . . . . 72.54 112.175 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.477 0.921 0 C-N-CA 122.774 0.429 . . . . 73.13 110.255 -172.174 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.658 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 12.9 mt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 107.984 -1.117 . . . . 65.34 107.984 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . 0.468 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 7.1 mp -53.26 -39.22 63.69 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.699 1.599 . . . . 74.53 112.2 175.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.473 ' HZ ' HG21 ' A' ' 76' ' ' ILE . 81.6 m-85 -122.87 35.07 4.96 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.331 0.653 . . . . 74.25 111.16 -173.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.658 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 38.3 tttm -63.3 -52.42 62.01 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.066 0.848 . . . . 72.13 110.45 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -75.02 -37.63 61.72 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.653 -0.703 . . . . 71.12 110.737 -175.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.69 -39.08 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 122.598 0.359 . . . . 75.34 110.814 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.4 -25.33 50.72 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.082 0.553 . . . . 75.41 110.767 176.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.71 -43.93 97.9 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.63 -0.507 . . . . 74.12 109.63 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -58.68 7.41 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.375 -0.602 . . . . 75.32 109.375 171.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.4 mt -54.42 -32.55 57.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.823 0.849 . . . . 72.44 112.466 -177.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.9 t -78.36 -47.1 18.39 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.631 0.772 . . . . 71.23 111.237 -176.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.648 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 22.5 t70 -69.34 -41.36 76.75 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 121.427 0.632 . . . . 53.22 110.436 -177.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.18 -48.54 86.52 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 CA-C-N 114.792 -1.095 . . . . 74.45 109.706 171.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . 0.578 ' HE3' HD22 ' A' ' 112' ' ' LEU . 10.6 t-105 -63.15 -25.62 68.43 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.333 0.653 . . . . 75.24 112.119 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.648 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.6 mtpt -63.66 -63.05 1.28 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.701 -0.851 . . . . 74.24 108.701 171.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.33 -47.23 72.75 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.91 0.862 . . . . 73.31 110.679 -177.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.578 HD22 ' HE3' ' A' ' 109' ' ' TRP . 47.5 tp -60.11 -56.25 23.89 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 112.902 -1.954 . . . . 75.41 110.529 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 91.3 p -61.25 -33.86 74.21 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.562 0.345 . . . . 75.45 111.843 -176.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.3 mt -63.33 -54.86 30.32 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 123.814 0.696 . . . . 75.23 110.134 176.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 pp -69.38 -23.7 63.77 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 111.84 0.311 . . . . 75.32 111.84 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.439 HD12 ' SD ' ' A' ' 122' ' ' MET . 85.8 mt -70.78 -45.03 65.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.891 0.476 . . . . 72.42 111.28 174.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -79.29 -31.11 43.23 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 122.111 -0.368 . . . . 75.31 111.6 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 76.3 t -83.47 -48.64 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 C-N-CA 122.7 0.4 . . . . 64.11 110.965 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -90.85 -57.94 2.64 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.272 0.558 . . . . 75.32 111.22 -176.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -83.03 -0.76 50.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.577 -0.738 . . . . 73.42 111.644 -170.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 62.26 24.16 14.35 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.156 1.382 . . . . 73.32 113.44 171.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.767 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 49.1 ttm -78.06 131.66 69.15 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 123.936 0.894 . . . . 72.43 110.396 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 C--N 1.378 2.082 0 C-N-CA 122.127 1.885 . . . . 75.14 111.799 179.126 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.1 m0 . . . . . 0 N--CA 1.482 1.17 0 N-CA-C 113.364 0.876 . . . . 75.32 113.364 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.63 -55.28 16.01 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.155 0.582 . . . . 75.2 110.281 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -29.41 70.61 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.186 -0.915 . . . . 73.41 111.7 -177.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.687 ' HB3' ' HD2' ' A' ' 30' ' ' ARG . 34.9 mt-10 -57.04 -60.46 3.56 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.706 1.202 . . . . 73.42 110.787 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.525 ' HB3' HD12 ' A' ' 96' ' ' ILE . 32.5 m-20 -56.36 -39.8 73.48 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 116.293 -0.412 . . . . 74.22 111.431 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.23 -64.45 0.86 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 123.141 0.276 . . . . 74.4 111.043 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -62.36 -50.54 71.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.571 0.701 . . . . 53.54 110.674 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . 0.538 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 3.1 m-20 -75.48 -40.54 57.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.234 -1.348 . . . . 73.44 112.135 -167.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . 0.473 ' HB3' HH22 ' A' ' 30' ' ' ARG . . . -74.36 -22.39 59.24 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 118.923 0.783 . . . . 63.03 111.269 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 35.7 t70 -70.98 -34.5 71.46 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 109.76 -0.459 . . . . 72.52 109.76 169.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -68.62 -35.46 77.34 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.203 0.601 . . . . 73.35 111.199 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.38 -36.45 68.73 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.156 0.582 . . . . 73.35 110.467 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -58.37 -45.56 88.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.657 -1.156 . . . . 71.53 109.958 171.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 48.5 mtt180 -66.99 -39.9 87.24 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 116.104 -0.498 . . . . 74.04 110.321 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . 0.428 ' O ' HD11 ' A' ' 151' ' ' LEU . . . -71.16 -23.01 61.98 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.287 0.635 . . . . 74.44 111.617 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . 0.425 ' HB3' HE21 ' A' ' 149' ' ' GLN . 0.1 OUTLIER -86.95 -60.5 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.415 0.626 . . . . 64.3 111.251 175.452 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' A' ' 148' ' ' PHE . 33.1 mm-40 -82.69 -27.09 31.48 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.904 -1.044 . . . . 74.33 112.654 -165.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.1 ttm -100.04 -70.88 0.72 Allowed 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.788 -0.819 . . . . 72.25 108.788 173.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . 0.428 HD11 ' O ' ' A' ' 147' ' ' ALA . 16.6 tp . . . . . 0 CA--C 1.558 1.261 0 C-N-CA 125.221 1.409 . . . . 73.3 111.818 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 121.349 0.595 . . . . 71.31 110.109 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -71.02 -29.28 65.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.692 -1.14 . . . . 74.52 110.842 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.412 HD21 HD11 ' A' ' 42' ' ' LEU . 0.9 OUTLIER -73.59 -40.17 64.08 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.162 -0.681 . . . . 75.23 109.162 -179.196 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.442 ' O ' ' HD3' ' A' ' 5' ' ' LYS . 6.8 tmtt? -71.38 -30.98 66.77 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.305 -0.998 . . . . 75.23 108.305 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.491 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 57.5 t-80 -64.61 -40.61 95.8 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 119.304 -0.379 . . . . 65.43 110.14 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 93.6 mt -56.83 -46.14 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 C-N-CA 124.262 1.025 . . . . 74.54 110.526 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.493 HD12 ' HG2' ' A' ' 43' ' ' GLU . 34.1 mm -54.54 -54.15 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 115.16 -0.927 . . . . 73.43 110.547 174.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.2 m -57.52 -40.1 78.03 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 124.409 1.084 . . . . 73.42 111.252 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 93.4 mt -61.18 -57.9 10.53 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 123.923 0.764 . . . . 75.3 109.99 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . 0.592 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.18 -36.04 73.17 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 124.65 1.219 . . . . 74.4 113.583 -176.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -62.8 -54.39 39.69 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.876 0.47 . . . . 70.32 110.904 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.62 -31.19 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.73 0.812 . . . . 74.23 111.269 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.495 HG21 HD11 ' A' ' 76' ' ' ILE . 36.5 mt -61.96 -60.12 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.612 1.165 . . . . 74.4 109.261 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -66.27 -27.83 68.24 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 123.249 0.343 . . . . 70.41 111.002 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -63.46 -48.41 77.82 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.712 . . . . 73.23 110.55 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -83.93 -16.2 45.1 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.001 0.521 . . . . 75.22 111.888 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 42.6 t -66.27 -21.58 66.29 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.056 0.543 . . . . 72.54 110.354 172.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.78 -21.59 66.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.6 0.76 . . . . 65.52 111.855 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -68.33 -14.15 62.79 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.205 0.602 . . . . 74.54 112.47 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' MET . . . . . 0.467 ' HE3' HG22 ' A' ' 76' ' ' ILE . 9.4 mmt -77.07 85.34 3.57 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.088 0.47 . . . . 65.52 110.352 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -40.79 76.55 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.673 -0.862 . . . . 72.42 108.673 167.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -106.81 164.82 11.79 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.484 -1.235 . . . . 73.31 109.216 170.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.633 ' SG ' HG22 ' A' ' 85' ' ' ILE . 29.3 m 58.93 53.26 5.78 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 124.342 1.026 . . . . 71.25 110.023 -167.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.504 ' HB3' ' HZ2' ' A' ' 25' ' ' LYS . 7.4 mtpm? -73.84 -42.16 61.24 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.008 -1.451 . . . . 74.33 111.765 -170.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.488 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 22.5 tptp -74.33 -45.02 49.95 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.208 -0.905 . . . . 74.24 109.867 -170.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -76.23 -22.22 55.46 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 116.026 -0.534 . . . . 74.21 111.24 176.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 14.0 t -61.57 -50.92 70.7 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.756 -0.461 . . . . 71.44 109.756 169.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -62.07 -38.7 89.82 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.181 0.925 . . . . 75.4 111.288 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HB3' HH21 ' A' ' 34' ' ' ARG . 4.1 mmp_? -51.06 -61.72 2.06 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.383 0.427 . . . . 71.44 110.01 172.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.62 -46.44 80.93 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.522 1.139 . . . . 71.31 110.887 -175.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.31 -49.89 58.94 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.967 0.792 . . . . 52.2 113.179 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -59.36 -38.13 79.63 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.536 0.735 . . . . 75.31 111.261 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.564 HH21 ' HB3' ' A' ' 30' ' ' ARG . 14.5 mtt180 -60.44 -59.42 5.44 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 123.721 0.638 . . . . 71.44 110.477 175.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.494 HG23 HG23 ' A' ' 14' ' ' ILE . 53.6 t -57.68 -41.07 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 124.516 1.135 . . . . 63.42 111.467 -174.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.17 -43.23 98.86 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.704 0.628 . . . . 71.33 110.053 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.88 -22.55 72.16 Favored Glycine 0 CA--C 1.537 1.43 0 O-C-N 123.448 0.468 . . . . 73.43 113.442 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 39.4 mt -84.35 -44.78 13.44 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 122.833 0.453 . . . . 63.21 110.983 178.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.592 HG21 ' HA3' ' A' ' 11' ' ' GLY . 13.3 pt -85.17 -25.06 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-O 118.964 -0.541 . . . . 65.24 111.989 -172.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -54.41 -56.01 31.24 Favored Pre-proline 0 CA--C 1.571 1.787 0 C-N-CA 123.598 0.759 . . . . 72.23 112.336 -176.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -72.28 -33.82 8.65 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.025 1.817 . . . . 71.22 111.944 -175.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD11 HD21 ' A' ' 4' ' ' LEU . 4.4 mm? -65.37 -39.5 92.38 Favored 'General case' 0 C--N 1.352 0.685 0 O-C-N 123.934 0.771 . . . . 75.01 109.497 176.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 8' ' ' ILE . 3.7 mm-40 -64.4 -39.92 94.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.107 0.963 . . . . 74.21 111.443 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 31.9 mmt -60.36 -53.52 56.59 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 123.658 0.599 . . . . 71.03 110.549 177.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.6 mt -71.5 -26.6 62.74 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.565 0.746 . . . . 75.15 112.187 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -46.42 26.36 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.964 0.906 . . . . 74.35 109.464 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 123.256 0.623 . . . . 72.22 110.771 -178.494 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.584 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 45.2 t . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 108.091 -1.077 . . . . 64.4 108.091 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.45 -44.83 81.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.749 0.42 . . . . 73.54 110.276 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -70.95 -29.16 65.09 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.835 0.854 . . . . 64.22 111.166 176.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 55' ' ' SER . 1.7 tm? -62.17 -48.66 79.07 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 107.825 -1.176 . . . . 72.13 107.825 176.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -64.88 -41.31 95.73 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.94 -1.027 . . . . 71.22 110.587 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.8 m -60.77 -44.66 96.48 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.696 0.623 . . . . 73.41 110.668 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.95 97.53 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.769 0.827 . . . . 52.44 110.102 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.97 -26.11 64.88 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.322 0.649 . . . . 72.42 111.564 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -75.65 -39.49 57.61 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.198 0.599 . . . . 75.41 110.393 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -72.13 -33.29 67.67 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.53 0.732 . . . . 64.21 110.335 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.71 -48.01 64.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.293 1.037 . . . . 74.11 108.785 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -55.47 -53.29 58.12 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 124.592 1.157 . . . . 70.13 110.591 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.67 94.09 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.559 0.743 . . . . 75.02 111.531 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.65 -36.12 81.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.506 0.722 . . . . 64.41 111.38 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 mt -71.36 -33.59 69.71 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.875 0.47 . . . . 73.54 111.057 177.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -67.05 -34.89 78.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.681 0.392 . . . . 72.43 110.174 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 46.8 mt-10 -64.55 -44.12 91.78 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.626 -0.715 . . . . 74.11 110.741 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.483 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.91 -46.73 89.48 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 123.545 0.528 . . . . 74.1 110.646 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -56.87 -44.03 81.84 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.152 1.381 . . . . 74.33 110.22 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.01 -40.43 97.11 Favored Glycine 0 C--N 1.35 1.341 0 O-C-N 124.058 0.849 . . . . 73.51 113.322 178.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 8.4 mm-40 -59.9 -60.29 4.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.946 0.498 . . . . 74.25 110.509 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.542 HG21 ' HZ ' ' A' ' 98' ' ' PHE . 1.4 pt -66.97 -20.31 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 112.586 0.588 . . . . 74.1 112.586 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -63.4 -48.74 76.58 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.819 -0.808 . . . . 71.44 108.819 171.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.507 ' HG2' ' ND2' ' A' ' 84' ' ' ASN . 35.0 ttmt -76.18 -25.38 55.16 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.693 -0.685 . . . . 75.11 111.224 -177.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.47 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-30 -75.35 -4.38 38.98 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.513 0.725 . . . . 51.15 112.549 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.4 p -57.43 -25.54 59.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.983 0.513 . . . . 74.31 111.42 173.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -90.98 111.93 23.59 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 107.986 -1.116 . . . . 71.12 107.986 169.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -76.56 -29.74 56.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.657 0.783 . . . . 74.13 110.911 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.7 p -69.9 -31.65 69.55 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.035 0.534 . . . . 71.34 110.642 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.507 ' ND2' ' HG2' ' A' ' 78' ' ' LYS . 41.1 t30 -62.89 -44.44 96.09 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 123.601 0.76 . . . . 73.04 110.172 174.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.633 HG22 ' SG ' ' A' ' 24' ' ' CYS . 34.5 mt -57.17 -55.06 22.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.155 0 O-C-N 124.337 1.023 . . . . 74.33 108.918 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 36.5 t -53.73 -39.94 65.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 124.2 0.938 . . . . 74.22 111.866 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -63.41 -43.77 96.54 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 123.918 0.761 . . . . 75.22 111.585 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -28.35 45.84 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 110.17 -0.307 . . . . 73.22 110.17 177.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.04 -26.5 43.14 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.454 1.102 . . . . 73.21 111.061 -167.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.1 t -76.92 -28.16 55.18 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.882 -0.599 . . . . 74.41 110.412 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.01 -44.69 29.95 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.554 0.742 . . . . 64.01 110.651 178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.0 p . . . . . 0 N--CA 1.473 0.707 0 C-N-CA 123.659 0.784 . . . . 73.11 109.007 177.315 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 137' ' ' ASP . 2.5 mp . . . . . 0 CA--C 1.551 0.991 0 N-CA-C 109.248 -0.649 . . . . 72.41 109.248 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.4 tp -47.53 -42.27 22.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.284 1.033 . . . . 70.01 111.331 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PHE . . . . . 0.542 ' HZ ' HG21 ' A' ' 76' ' ' ILE . 32.7 m-85 -120.73 32.27 6.06 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 114.697 -1.138 . . . . 74.41 111.181 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -48.54 -63.22 1.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.905 0.882 . . . . 74.54 112.792 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.87 -48.91 67.34 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.896 0.879 . . . . 52.24 111.12 -174.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.62 -40.01 85.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 114.713 -1.13 . . . . 62.41 110.981 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -76.95 -28.85 55.36 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.1 0.56 . . . . 72.13 110.74 -176.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -61.88 -40.83 96.76 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 109.045 -0.724 . . . . 75.11 109.045 172.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.64 -48.64 71.5 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 123.762 0.663 . . . . 75.25 111.191 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.4 mp -55.3 -47.05 76.16 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.277 0.631 . . . . 73.44 110.534 177.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.503 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 33.6 t -65.26 -49.89 67.86 Favored 'General case' 0 C--O 1.212 -0.917 0 O-C-N 124.347 1.03 . . . . 75.22 110.599 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -56.34 -56.38 21.79 Favored 'General case' 0 C--O 1.261 1.669 0 O-C-N 124.224 0.953 . . . . 74.24 110.734 -176.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.523 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 47.8 t -62.33 -42.04 93.95 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.185 0 CA-C-N 113.926 -1.488 . . . . 72.31 110.136 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 20.1 t-105 -62.94 -43.46 98.74 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.734 0.646 . . . . 74.2 112.289 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 106' ' ' SER . 47.7 mtmt -59.52 -56.35 23.09 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.783 -0.451 . . . . 75.43 109.783 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.57 -21.76 61.83 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.881 -0.6 . . . . 73.45 111.862 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 3.3 tp -66.35 -60.0 3.17 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 107.158 -1.423 . . . . 74.43 107.158 176.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.8 t -52.72 -41.74 64.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 114.428 -1.26 . . . . 75.04 111.018 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 89.8 mt -58.6 -60.39 3.89 Favored 'General case' 0 C--N 1.361 1.076 0 O-C-N 124.149 0.906 . . . . 72.33 111.346 177.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.31 -27.76 69.25 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 120.698 0.285 . . . . 75.43 111.741 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.559 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 83.1 mt -67.13 -56.56 9.44 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 123.205 0.602 . . . . 74.55 110.389 177.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.71 -31.34 66.63 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.357 0.502 . . . . 73.25 112.357 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 88.1 t -77.13 -57.36 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.438 0.461 . . . . 73.4 110.261 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -97.04 -57.32 2.3 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.099 0.56 . . . . 74.32 111.16 -168.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -1.49 22.0 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.267 0.627 . . . . 62.12 111.37 -175.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 65.62 12.42 8.22 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.632 1.573 . . . . 72.45 112.182 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' MET . . . . . 0.559 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 66.8 mtp -87.01 110.96 37.18 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.176 0.99 . . . . 72.34 110.691 -173.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo . . . . . 0 C--N 1.372 1.78 0 C-N-CA 123.19 2.593 . . . . 64.42 111.4 -177.218 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' TRP . . . . . 0.415 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 47.4 m0 . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 112.187 0.44 . . . . 75.44 112.187 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.9 74.51 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 122.782 0.433 . . . . 72.35 111.544 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -89.73 -39.69 12.99 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.644 0.778 . . . . 72.12 111.135 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 133' ' ' TRP . 20.5 mm-40 -65.92 -64.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.076 0.55 . . . . 71.41 110.878 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' ASP . . . . . 0.42 ' HB3' HG23 ' A' ' 96' ' ' ILE . 3.7 m-20 -48.14 -36.56 13.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.554 1.142 . . . . 71.43 112.324 178.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -66.83 -58.7 4.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.73 0.812 . . . . 75.1 111.269 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.89 -39.05 87.8 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.445 0.641 . . . . 73.13 110.754 -177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -39.29 90.75 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 114.479 -1.237 . . . . 75.2 110.229 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.03 -48.9 79.81 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.648 0.379 . . . . 74.25 111.03 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.04 -54.05 51.33 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 124.248 0.967 . . . . 72.34 111.298 177.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -76.6 -21.96 54.86 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.33 0.863 . . . . 74.44 113.33 -172.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 32.4 t0 -86.71 -34.55 19.66 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.917 -0.401 . . . . 65.02 109.917 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -65.95 -38.19 87.95 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.043 -0.526 . . . . 72.43 109.985 168.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -64.3 -41.83 96.66 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.37 -0.832 . . . . 73.45 109.576 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.28 -27.57 60.8 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.502 0.721 . . . . 74.43 111.931 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.18 -58.29 3.36 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.461 -0.57 . . . . 64.01 109.461 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -67.59 -44.3 78.45 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.655 -1.157 . . . . 74.14 111.255 -172.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 46.6 ttm -83.7 -79.3 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.33 -0.618 . . . . 74.22 109.33 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 61.0 tp . . . . . 0 N--CA 1.484 1.271 0 C-N-CA 124.457 1.103 . . . . 75.4 111.202 -172.661 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ptp . . . . . 0 N--CA 1.484 1.227 0 CA-C-O 119.648 -0.215 . . . . 74.03 110.804 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.02 -61.48 2.42 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.143 0.977 . . . . 75.32 112.855 -168.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.69 -37.51 87.63 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.303 0.641 . . . . 71.44 110.441 -174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.641 ' HG ' ' SD ' ' A' ' 62' ' ' MET . 7.4 tt -62.46 -40.73 97.59 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.837 -1.074 . . . . 74.52 109.836 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.64 -32.0 71.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.692 0.797 . . . . 74.44 110.519 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -63.98 -40.01 95.42 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 119.336 -0.364 . . . . 75.5 110.659 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.546 HD11 ' HB3' ' A' ' 65' ' ' PHE . 29.4 mt -59.51 -46.05 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 CA-C-O 120.979 0.419 . . . . 74.12 110.493 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.401 HG12 ' O ' ' A' ' 4' ' ' LEU . 46.1 mm -61.98 -45.7 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.101 -0.954 . . . . 75.31 111.139 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.7 m -62.75 -53.04 60.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.791 0.836 . . . . 65.44 110.248 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.6 mt -50.13 -47.24 54.22 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 124.487 1.117 . . . . 73.53 110.221 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.434 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -58.42 -52.81 50.56 Favored Glycine 0 C--N 1.342 0.877 0 O-C-N 124.243 0.964 . . . . 75.14 113.809 -175.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.0 -40.28 94.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.585 0.354 . . . . 73.12 111.286 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.486 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 65.2 t -64.91 -38.52 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 115.798 -0.637 . . . . 64.3 110.825 176.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.523 HD11 ' O ' ' A' ' 69' ' ' LEU . 20.1 mt -63.65 -51.46 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.45 1.1 . . . . 74.02 110.079 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.508 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 69.8 t60 -54.91 -46.76 74.92 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.46 1.1 . . . . 73.31 109.632 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.1 tptm -62.63 -53.71 50.51 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 124.505 1.128 . . . . 73.43 111.91 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.6 ptp180 -74.48 -22.67 58.97 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.792 0.437 . . . . 71.5 111.772 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.508 ' SG ' HD21 ' A' ' 31' ' ' LEU . 52.4 t -67.0 -26.0 66.58 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.609 0.364 . . . . 74.12 111.292 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.508 ' HG3' ' O ' ' A' ' 15' ' ' HIS . 44.4 mt-10 -74.32 5.72 4.3 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 112.966 0.728 . . . . 74.14 112.966 -175.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.49 ' HG3' ' NH1' ' A' ' 82' ' ' ARG . 14.8 pt-20 -86.15 -13.85 45.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.687 0.395 . . . . 74.34 111.439 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.531 ' HA ' ' HD2' ' A' ' 82' ' ' ARG . 14.2 mmt -76.24 95.07 3.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.846 0.458 . . . . 73.43 110.452 -176.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -73.07 -32.64 65.14 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.321 0.582 . . . . 74.24 109.937 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -94.61 153.8 17.67 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.335 -0.987 . . . . 71.14 108.335 166.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.543 ' SG ' HD11 ' A' ' 97' ' ' LEU . 95.3 m 60.51 55.33 3.46 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 124.131 0.894 . . . . 70.11 110.342 -170.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.81 -48.2 59.96 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.183 -0.917 . . . . 74.4 111.022 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.522 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.3 mtpm? -72.7 -32.99 66.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.881 0.472 . . . . 74.44 110.421 -173.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.534 ' HG2' HH12 ' A' ' 30' ' ' ARG . 48.0 mt-30 -71.64 -31.09 66.47 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.368 0.267 . . . . 74.44 111.174 172.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.6 t -67.41 -39.44 85.53 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.257 0.623 . . . . 63.54 110.532 173.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -74.4 -32.12 62.59 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 114.849 -1.069 . . . . 74.31 110.749 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.534 HH12 ' HG2' ' A' ' 27' ' ' GLN . 40.0 ttp-105 -77.61 -39.91 43.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.32 0.648 . . . . 74.41 110.205 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.508 HD21 ' SG ' ' A' ' 18' ' ' CYS . 61.6 tp -61.25 -47.14 87.38 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.713 -0.847 . . . . 74.32 108.713 172.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.37 -41.09 98.34 Favored Glycine 0 C--N 1.351 1.415 0 O-C-N 123.928 0.767 . . . . 72.32 113.004 176.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -59.98 -51.85 67.92 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.063 0.945 . . . . 74.44 110.677 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.581 ' NH2' ' HB3' ' A' ' 133' ' ' TRP . 34.9 mtt180 -59.78 -62.39 1.91 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.201 -1.363 . . . . 75.34 110.632 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.4 t -51.13 -46.31 31.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 124.453 1.096 . . . . 55.44 111.951 -173.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.491 HD23 HD13 ' A' ' 39' ' ' ILE . 94.7 mt -67.46 -44.25 79.1 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.415 0.447 . . . . 64.2 110.745 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.38 -19.44 62.13 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.266 0.354 . . . . 75.33 113.741 175.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 81.0 mt -86.69 -52.58 5.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.825 0.85 . . . . 72.31 111.995 177.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.491 HD13 HD23 ' A' ' 36' ' ' LEU . 12.7 pt -73.99 -46.69 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 118.758 -0.639 . . . . 73.42 111.769 -169.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.489 ' HE2' ' HB3' ' A' ' 36' ' ' LEU . 68.3 mttm -53.57 -50.22 84.38 Favored Pre-proline 0 N--CA 1.489 1.506 0 CA-C-O 118.416 -0.802 . . . . 74.13 113.094 -173.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.463 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 49.4 Cg_exo -55.87 -54.02 4.7 Favored 'Trans proline' 0 C--N 1.395 3.005 0 C-N-CA 121.963 1.775 . . . . 64.32 112.045 176.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HA ' HD13 ' A' ' 45' ' ' LEU . 4.3 mm? -64.39 -23.36 67.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.488 0.715 . . . . 75.33 111.647 -176.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 45.7 mt-10 -71.65 -44.18 64.77 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.739 0.816 . . . . 74.43 110.572 172.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 32.7 mmt -69.55 -26.89 64.71 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.529 0.518 . . . . 73.25 110.983 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 42' ' ' LEU . 39.2 mt -78.61 -37.14 43.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 64.03 109.987 176.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -68.84 -32.63 72.45 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 115.648 -0.705 . . . . 73.52 110.123 174.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.17 -52.82 24.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.404 1.082 . . . . 73.35 110.907 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -68.31 -25.87 65.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.918 -0.583 . . . . 75.1 110.841 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.56 99.91 1.41 Allowed Glycine 0 C--N 1.349 1.276 0 CA-C-N 115.963 -0.562 . . . . 45.13 112.308 176.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.87 119.7 26.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 107.925 -1.139 . . . . 73.32 107.925 177.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -55.18 129.87 39.87 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.098 0.959 . . . . 74.11 112.431 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.7 m -78.6 84.36 4.72 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.401 0.68 . . . . 64.53 110.217 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.4 p -167.59 75.98 0.96 Allowed Pre-proline 0 CA--C 1.556 1.176 0 CA-C-N 114.721 -1.127 . . . . 74.51 108.903 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -86.13 109.86 1.0 Allowed 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.489 2.126 . . . . 72.05 112.484 177.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.418 ' H ' HD13 ' A' ' 58' ' ' LEU . 4.5 m -62.26 172.58 1.42 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.065 0.946 . . . . 74.11 110.609 171.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.06 -42.73 77.09 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.796 0.438 . . . . 63.33 110.075 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.455 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.53 -45.68 88.38 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.09 -0.959 . . . . 71.3 111.75 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.443 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 97.6 mt -74.14 -37.08 64.15 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.816 0.846 . . . . 72.23 111.115 -172.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 67.0 m -62.6 -55.46 26.9 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.95 0.781 . . . . 72.24 109.203 175.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 26.4 m -62.89 -36.03 81.97 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.755 -0.657 . . . . 74.41 111.246 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.467 ' HB2' HD13 ' A' ' 112' ' ' LEU . . . -64.08 -48.93 74.27 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.388 0.675 . . . . 73.14 111.016 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.641 ' SD ' ' HG ' ' A' ' 4' ' ' LEU . 32.8 mmt -68.54 -30.08 68.79 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.548 -0.751 . . . . 72.34 111.992 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -76.37 -36.72 57.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.537 0.335 . . . . 75.44 111.165 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -67.41 -41.92 84.1 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.604 0.762 . . . . 71.45 109.512 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.546 ' HB3' HD11 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -67.03 -49.41 65.32 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.364 -0.834 . . . . 75.11 109.511 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.478 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.3 ttpp -53.59 -51.69 62.19 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.619 0.574 . . . . 73.1 110.267 178.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.98 89.51 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.263 0.977 . . . . 74.13 112.093 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.493 ' HB2' HD13 ' A' ' 105' ' ' LEU . . . -63.97 -44.5 92.56 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.755 0.822 . . . . 62.32 111.102 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.523 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -69.77 -29.45 66.79 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.247 -0.888 . . . . 75.42 110.708 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.7 mt-10 -65.76 -38.48 89.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.584 -0.697 . . . . 61.14 109.856 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.407 ' HB2' HG12 ' A' ' 101' ' ' VAL . 44.0 mt-10 -61.84 -52.2 65.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.45 -0.795 . . . . 73.42 110.144 174.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.7 79.93 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 123.876 0.735 . . . . 74.11 111.367 -178.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -59.64 -48.3 82.2 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.698 1.199 . . . . 71.14 110.645 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.23 91.71 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.195 -0.911 . . . . 71.32 113.18 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -67.77 -54.01 22.65 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 119.073 -0.489 . . . . 73.24 110.95 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.411 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.4 OUTLIER -63.31 -33.71 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 112.02 0.378 . . . . 73.2 112.02 177.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.16 -33.22 75.5 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 120.973 0.416 . . . . 71.53 110.262 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -80.73 -27.78 36.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.5 0.72 . . . . 62.04 110.855 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.3 m-85 -87.1 9.4 19.96 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.004 0.922 . . . . 73.45 111.32 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -57.16 -16.79 8.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.073 0.949 . . . . 72.43 112.306 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -110.3 115.14 29.15 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 108.027 -1.101 . . . . 74.0 108.027 167.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.531 ' HD2' ' HA ' ' A' ' 21' ' ' MET . 1.0 OUTLIER -72.82 -24.65 60.93 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.423 0.689 . . . . 71.23 111.373 178.652 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 p -64.95 -37.47 87.75 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.311 0.644 . . . . 72.23 110.326 170.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.79 -38.28 86.21 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.856 0.862 . . . . 65.32 110.601 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.525 HG21 ' HG ' ' A' ' 24' ' ' CYS . 36.2 mt -57.7 -49.16 81.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 108.862 -0.792 . . . . 74.12 108.862 175.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.01 -35.08 79.02 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.425 0.453 . . . . 74.15 111.606 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -60.8 -45.11 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.699 0.624 . . . . 74.42 111.054 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.403 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -80.54 -27.51 37.56 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 110.384 -0.228 . . . . 71.4 110.384 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 14.6 tp -67.61 -44.25 78.5 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.518 1.127 . . . . 74.2 111.164 -171.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -65.63 -13.58 59.41 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.868 -1.06 . . . . 74.31 111.65 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.26 -21.75 12.4 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.082 0.953 . . . . 74.31 111.402 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.1 t -68.65 113.44 6.15 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.948 0.899 . . . . 74.33 110.147 -175.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -69.0 -33.99 74.56 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.26 1.024 . . . . 62.42 111.091 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -83.16 148.27 27.56 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.757 -0.831 . . . . 72.32 108.757 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -96.49 18.58 13.74 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 74.04 110.84 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.557 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 7.0 mt -124.14 128.72 74.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 C-N-CA 124.33 1.052 . . . . 75.15 108.259 -178.086 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.543 HD11 ' SG ' ' A' ' 24' ' ' CYS . 20.2 mt -65.87 -54.1 31.11 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 122.142 0.972 . . . . 73.31 109.621 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.468 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 21.9 m-85 -94.44 36.72 1.14 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.628 -1.624 . . . . 74.24 109.947 -174.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.557 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 1.6 tmmt? -52.53 -62.46 1.63 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.152 0.433 . . . . 74.35 110.844 -176.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -61.85 -60.84 3.05 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.262 0.625 . . . . 74.43 110.802 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.407 HG12 ' HB2' ' A' ' 71' ' ' GLU . 77.9 t -50.34 -57.85 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.898 1.279 . . . . 75.42 112.807 -174.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.458 ' HA ' HD12 ' A' ' 105' ' ' LEU . 65.3 t30 -73.83 -22.25 59.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.985 -1.007 . . . . 64.44 110.349 -174.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.1 -43.65 95.39 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.203 -0.427 . . . . 74.44 110.126 166.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -56.75 -46.91 81.11 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 119.386 -0.34 . . . . 74.32 110.665 172.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.493 HD13 ' HB2' ' A' ' 68' ' ' ALA . 9.9 mp -53.21 -41.66 65.55 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 117.784 0.265 . . . . 62.11 111.142 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.451 ' HA ' ' HE3' ' A' ' 133' ' ' TRP . 38.9 t -67.53 -43.94 79.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.884 0.874 . . . . 53.42 111.577 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 68.7 m-20 -69.79 -55.16 10.59 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.411 -0.813 . . . . 73.22 110.243 -177.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.7 t -63.28 -32.75 57.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 119.532 -0.271 . . . . 71.32 111.225 -176.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.612 ' HH2' HG11 ' A' ' 124' ' ' VAL . 16.4 t-105 -67.46 -48.18 67.95 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.02 -0.514 . . . . 74.44 111.738 174.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 41.4 pttt -60.72 -42.09 96.58 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 109.327 -0.62 . . . . 74.44 109.327 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.39 -35.56 75.91 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.391 1.076 . . . . 71.53 110.607 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.467 HD13 ' HB2' ' A' ' 61' ' ' ALA . 0.3 OUTLIER -61.14 -59.81 4.74 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 107.948 -1.131 . . . . 75.14 107.948 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.9 t -53.97 -35.49 61.87 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.905 -1.498 . . . . 71.43 110.973 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.2 mt -63.22 -62.95 1.35 Allowed 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.154 0.582 . . . . 72.44 111.533 172.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.455 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 3.8 pp -63.19 -28.61 70.16 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.134 0.42 . . . . 73.13 112.134 -173.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 91.7 mt -65.28 -57.9 7.28 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.292 -0.867 . . . . 72.34 109.878 173.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -68.17 -23.72 64.89 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 112.18 0.437 . . . . 72.34 112.18 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 85.4 t -83.94 -63.96 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.376 0.271 . . . . 75.33 111.003 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -93.87 -44.48 8.08 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 122.253 -0.279 . . . . 64.15 111.537 -170.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -71.21 -17.63 62.51 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 116.674 -0.239 . . . . 73.15 110.481 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 65.82 9.73 6.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.741 1.617 . . . . 74.21 111.363 -177.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.534 ' HG2' HG22 ' A' ' 124' ' ' VAL . 33.1 ttp -94.61 111.12 52.81 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.476 1.11 . . . . 75.35 109.432 -170.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -90.41 43.85 0.55 Allowed 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 124.004 3.136 . . . . 72.24 112.915 -165.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.612 HG11 ' HH2' ' A' ' 109' ' ' TRP . 86.6 t -65.75 103.16 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.043 0.937 . . . . 64.43 111.285 -175.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 39.9 t -162.0 79.45 1.98 Allowed Pre-proline 0 CA--C 1.546 0.824 0 CA-C-N 114.386 -1.279 . . . . 74.44 108.108 172.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.463 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 61.4 Cg_endo -81.79 27.21 0.59 Allowed 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 123.156 2.571 . . . . 73.32 112.775 177.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 13.3 tt -145.24 -58.59 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 122.562 0.345 . . . . 73.44 111.582 -168.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 29.7 p -175.82 -68.1 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.28 0.632 . . . . 74.45 109.854 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.73 -57.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.028 -1.471 . . . . 75.3 107.028 -174.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.67 -7.04 10.39 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.977 -1.01 . . . . 53.51 113.909 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.17 -39.28 29.62 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 117.661 0.731 . . . . 53.32 111.138 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 m -62.92 -13.11 30.39 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.65 1.18 . . . . 65.15 112.605 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.581 ' HB3' ' NH2' ' A' ' 34' ' ' ARG . 12.3 m0 -58.82 -18.04 28.96 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.122 1.369 . . . . 75.53 113.983 176.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.35 93.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.289 0.236 . . . . 65.13 110.792 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -72.58 -32.34 65.93 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.393 0.677 . . . . 64.15 111.319 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.493 ' HG2' ' HD2' ' A' ' 30' ' ' ARG . 29.4 tt0 -61.99 -58.67 6.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.694 0.798 . . . . 75.32 109.973 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -37.83 83.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.061 0.544 . . . . 75.1 111.835 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -56.01 -63.76 1.08 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.79 0.681 . . . . 73.4 110.948 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -71.46 -46.19 60.6 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.524 0.515 . . . . 73.44 110.862 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.94 -43.01 72.48 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.923 -0.58 . . . . 61.44 111.129 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.418 ' HB3' HG12 ' A' ' 96' ' ' ILE . . . -78.05 -25.36 47.71 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 123.212 0.32 . . . . 75.32 111.096 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -58.21 -53.72 55.1 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.318 -0.623 . . . . 70.22 109.318 170.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -58.65 -44.61 90.16 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 114.341 -1.3 . . . . 72.41 111.693 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.522 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 34.0 t70 -80.88 -32.25 34.97 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.952 0.782 . . . . 72.43 112.87 -168.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -70.2 -41.33 73.82 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.288 -1.005 . . . . 74.44 108.288 174.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 ttm180 -62.42 -37.44 85.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 114.726 -1.124 . . . . 73.23 109.954 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.87 -17.82 59.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.438 0.695 . . . . 73.34 111.396 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.487 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 1.6 t80 -69.98 -59.81 2.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.238 -1.023 . . . . 70.44 108.238 171.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.92 -38.65 72.95 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 113.874 -1.512 . . . . 74.12 111.595 -170.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 87.4 mmm -103.55 31.7 4.25 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.196 0.999 . . . . 74.34 110.131 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.537 HD23 ' HB3' ' A' ' 154' ' ' ASP . 2.0 tt -76.38 84.91 3.14 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-O 121.583 0.706 . . . . 73.03 109.574 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -116.36 -11.46 11.21 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.68 1.192 . . . . 74.53 109.423 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -61.05 -48.98 79.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.289 1.436 . . . . 73.43 111.964 -177.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.537 ' HB3' HD23 ' A' ' 151' ' ' LEU . 39.1 t70 -91.08 25.54 2.43 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-O 121.982 0.896 . . . . 75.24 109.987 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -122.94 81.58 1.89 Allowed 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.666 -0.865 . . . . 72.11 108.666 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.561 1.372 0 C-N-CA 125.328 1.451 . . . . 74.02 111.846 -177.413 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 110.255 -0.276 . . . . 74.41 110.255 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.27 -55.24 26.41 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 124.055 0.942 . . . . 64.44 111.238 -175.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -59.65 -35.03 73.6 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.784 0.677 . . . . 73.44 111.562 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 30.5 tp -66.71 -44.56 81.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.888 0.475 . . . . 73.11 110.549 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -70.21 -25.35 63.36 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.791 0.436 . . . . 74.23 110.633 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -77.64 -29.96 51.98 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-O 118.993 -0.527 . . . . 72.13 110.768 173.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.46 -44.91 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 109.2 -0.667 . . . . 74.43 109.2 170.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 mm -60.42 -51.52 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-N 114.5 -1.227 . . . . 64.54 110.842 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.8 m -65.09 -56.77 11.09 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.329 0.652 . . . . 70.15 111.075 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.2 mt -51.7 -51.54 55.22 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.965 0.906 . . . . 73.5 111.199 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.26 -35.24 90.06 Favored Glycine 0 C--N 1.346 1.126 0 O-C-N 124.272 0.983 . . . . 74.12 114.05 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -69.16 -42.8 75.44 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.22 0.533 . . . . 65.13 109.729 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.439 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 62.8 t -62.06 -37.72 79.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-N 114.923 -1.035 . . . . 74.21 110.139 174.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.408 HG23 HG22 ' A' ' 35' ' ' VAL . 32.8 mt -58.04 -52.21 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.758 0.823 . . . . 74.33 110.131 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -60.16 -36.29 77.23 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.004 0.815 . . . . 73.32 110.982 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -66.29 -66.98 0.48 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 119.541 -0.266 . . . . 75.41 111.454 175.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -63.78 -20.17 65.56 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.355 0.872 . . . . 73.25 113.355 -172.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.414 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.5 t -65.33 -20.53 66.44 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.067 0.547 . . . . 72.21 112.077 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.28 -18.07 24.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.781 0.832 . . . . 65.23 113.07 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -65.85 -21.51 66.47 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.337 0.866 . . . . 74.54 113.337 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.529 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 7.6 mmt -75.57 87.7 2.68 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 121.16 0.505 . . . . 75.54 110.493 -173.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -35.59 63.79 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.787 -1.097 . . . . 72.3 108.447 170.146 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.424 ' O ' ' SG ' ' A' ' 24' ' ' CYS . 48.0 m-85 -92.64 152.89 19.31 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 108.129 -1.063 . . . . 74.21 108.129 169.372 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 23' ' ' TYR . 31.5 p 50.54 60.11 4.09 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.243 1.017 . . . . 72.35 110.413 -171.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 47.4 mtmt -66.58 -45.32 79.62 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 114.491 -1.231 . . . . 72.01 111.371 -174.788 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -71.42 -36.8 71.43 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 108.194 -1.039 . . . . 74.1 108.194 -170.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -43.86 79.94 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.066 1.346 . . . . 75.44 112.231 169.092 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 32.8 t -60.94 -39.79 90.83 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.683 0.793 . . . . 72.34 110.889 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.9 mpt_? -81.23 -22.44 38.76 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.628 0.771 . . . . 74.54 111.1 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.45 -60.45 2.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.632 0.773 . . . . 74.25 109.166 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 29.0 tp -58.23 -40.52 81.9 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.425 1.09 . . . . 73.43 110.196 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.04 -51.04 59.73 Favored Glycine 0 C--N 1.354 1.54 0 O-C-N 123.965 0.791 . . . . 71.15 112.458 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -71.59 -32.99 68.65 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.082 0.553 . . . . 74.4 111.387 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.768 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.9 mtt180 -62.37 -63.58 1.19 Allowed 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.419 0.449 . . . . 71.35 109.812 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.408 HG22 HG23 ' A' ' 14' ' ' ILE . 99.8 t -65.09 -41.14 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.549 -0.75 . . . . 72.44 111.219 -173.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.8 -40.94 98.9 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.344 0.592 . . . . 73.31 109.893 175.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.1 -22.09 75.84 Favored Glycine 0 C--O 1.216 -1.006 0 CA-C-N 114.702 -1.135 . . . . 70.05 113.083 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 90.5 mt -84.42 -39.7 18.68 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 117.838 0.819 . . . . 72.34 111.372 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 pt -81.66 -39.18 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 112.447 0.536 . . . . 74.53 112.447 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.447 ' O ' ' HG2' ' A' ' 44' ' ' MET . 31.2 mmtp -60.07 -53.79 61.7 Favored Pre-proline 0 N--CA 1.485 1.304 0 CA-C-O 118.004 -0.998 . . . . 74.13 112.518 -174.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 27.2 Cg_endo -60.17 -41.26 52.95 Favored 'Trans proline' 0 C--N 1.399 3.222 0 C-N-CA 122.08 1.853 . . . . 72.23 110.539 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.452 HD12 HD12 ' A' ' 45' ' ' LEU . 3.9 mm? -60.67 -35.66 76.8 Favored 'General case' 0 C--N 1.356 0.868 0 O-C-N 124.286 0.991 . . . . 75.21 111.667 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.16 -44.9 67.84 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.798 0.439 . . . . 73.43 110.943 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.447 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 36.2 mmt -57.13 -51.76 68.02 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.099 0.874 . . . . 75.23 110.265 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 41' ' ' PRO . 3.5 pp -77.16 -27.5 53.82 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.203 -0.453 . . . . 74.34 111.721 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -59.45 -39.14 82.64 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.654 0.661 . . . . 72.44 110.153 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -82.32 -45.04 15.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.157 -0.929 . . . . 73.2 111.562 -177.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -78.19 -58.86 3.03 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.964 0.505 . . . . 70.1 111.589 -176.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.15 91.87 0.09 OUTLIER Glycine 0 C--N 1.346 1.107 0 N-CA-C 112.162 -0.375 . . . . 65.54 112.162 -176.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -90.03 -32.34 16.79 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.463 1.105 . . . . 73.33 110.988 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 75.18 110.47 0.07 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.857 1.663 . . . . 72.44 109.556 -164.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.8 p -76.81 -171.28 1.87 Allowed 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.799 -1.091 . . . . 64.3 111.031 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 58.1 t 61.43 83.94 0.2 Allowed Pre-proline 0 C--O 1.244 0.765 0 C-N-CA 124.627 1.171 . . . . 73.51 109.566 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.563 ' HA ' HD21 ' A' ' 58' ' ' LEU . 58.7 Cg_endo -71.93 128.09 13.67 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 121.928 1.752 . . . . 72.12 111.341 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 p -64.96 169.18 5.52 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.387 0.675 . . . . 70.11 110.321 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -57.09 -51.33 69.74 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.15 0.58 . . . . 73.13 110.918 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 -27.25 62.39 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.33 -0.85 . . . . 72.45 111.883 -179.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.563 HD21 ' HA ' ' A' ' 54' ' ' PRO . 52.8 tp -72.55 -43.6 63.25 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.885 -0.413 . . . . 71.44 109.885 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.3 m -62.17 -49.68 74.85 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 123.787 0.835 . . . . 74.11 109.36 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 54.8 m -54.71 -44.93 73.89 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.038 0.935 . . . . 74.13 110.826 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.415 ' HB3' HD12 ' A' ' 112' ' ' LEU . . . -65.89 -38.57 89.09 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.634 0.774 . . . . 63.52 111.198 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.82 -30.44 66.87 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.914 0.485 . . . . 73.44 111.007 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -68.33 -45.99 71.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.039 0.536 . . . . 74.11 109.87 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -67.91 -39.38 83.58 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.469 -0.787 . . . . 74.52 111.32 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.403 ' CZ ' HD13 ' A' ' 38' ' ' LEU . 1.2 t80 -68.47 -46.42 69.81 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.154 0.982 . . . . 73.31 109.531 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -60.94 -44.83 96.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.894 1.278 . . . . 74.45 111.036 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.3 -38.47 90.31 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.235 0.614 . . . . 74.42 111.083 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.478 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -66.85 -33.93 76.68 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.335 -0.848 . . . . 64.45 110.947 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.74 -35.82 75.31 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.944 -0.571 . . . . 75.11 110.994 174.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.07 -38.56 91.51 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 122.951 0.5 . . . . 75.52 110.981 176.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.24 -51.4 67.91 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 123.959 0.787 . . . . 74.3 109.943 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.63 -35.85 79.08 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.597 0.759 . . . . 62.41 111.537 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -69.05 -41.58 77.45 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.773 1.229 . . . . 72.21 110.358 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.08 -33.8 65.04 Favored Glycine 0 C--N 1.347 1.171 0 CA-C-N 115.109 -0.951 . . . . 61.12 112.224 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -62.69 -50.85 69.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.089 0.556 . . . . 52.12 111.408 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.55 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -71.98 -28.01 28.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 112.231 0.456 . . . . 73.23 112.231 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.435 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 39.5 tt0 -62.83 -36.72 84.13 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.668 0.747 . . . . 61.45 109.583 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -77.8 -39.13 44.9 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 114.359 -1.291 . . . . 74.52 110.698 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.55 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 15.1 m-30 -76.59 -3.52 38.06 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 124.309 1.044 . . . . 74.23 112.081 -177.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.4 p -56.04 -31.36 63.06 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 121.507 0.67 . . . . 74.34 109.765 171.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.21 104.64 16.56 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.438 -1.319 . . . . 73.41 107.438 166.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -22.43 64.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.417 0.687 . . . . 75.3 110.724 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.7 m -58.62 -39.4 80.36 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.305 1.042 . . . . 65.3 110.966 170.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.13 -41.38 97.23 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 124.151 0.98 . . . . 70.42 110.818 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.472 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 29.0 mt -58.78 -51.17 75.35 Favored 'Isoleucine or valine' 0 C--N 1.362 1.11 0 O-C-N 123.956 0.785 . . . . 74.1 109.402 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 48.3 t -55.67 -46.18 77.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.88 0.872 . . . . 64.12 111.522 178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -59.32 -42.96 92.64 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.662 -1.154 . . . . 73.41 111.832 -176.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -24.89 27.48 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 119.305 -0.379 . . . . 73.34 110.513 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 16.5 tp -67.46 -39.27 85.32 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.493 0.717 . . . . 72.11 110.859 -172.298 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.8 t -65.81 -26.15 67.55 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 115.363 -0.835 . . . . 74.21 111.18 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.15 -3.99 30.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.157 0.983 . . . . 73.12 111.64 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 30.5 t -73.71 126.96 31.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.633 -0.506 . . . . 75.34 109.633 -175.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -86.4 -2.17 58.2 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.326 -0.852 . . . . 74.33 111.674 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -136.45 171.61 14.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.126 0.489 . . . . 74.32 109.941 174.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -83.56 -36.31 24.09 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.077 0.951 . . . . 70.35 110.599 -177.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp -80.01 127.87 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 108.858 -0.793 . . . . 74.21 108.858 -175.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.1 mt -61.95 -43.65 98.4 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.829 0.823 . . . . 72.24 110.41 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -105.58 45.31 0.98 Allowed 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.143 -1.39 . . . . 74.25 108.933 -177.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.15 -66.72 0.35 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 118.483 0.583 . . . . 72.52 110.35 -170.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.412 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 36.1 t70 -73.07 -41.04 64.55 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.713 0.633 . . . . 74.13 111.028 -176.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.42 -58.56 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 123.839 0.712 . . . . 75.4 110.902 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -74.95 -20.79 59.53 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.979 0.912 . . . . 74.22 111.274 -176.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -64.42 -37.12 86.42 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 108.936 -0.765 . . . . 74.3 108.936 167.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 61.1 mtpt -71.75 -37.01 70.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.2 0.6 . . . . 75.32 110.721 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.478 HD11 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -58.35 -47.44 83.78 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.938 -0.393 . . . . 74.22 109.938 171.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.768 ' HB2' HH12 ' A' ' 34' ' ' ARG . 35.1 t -66.55 -38.97 88.25 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.744 0.818 . . . . 75.44 111.362 -177.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.746 ' HA ' ' HE3' ' A' ' 110' ' ' LYS . 39.1 t70 -69.4 -55.46 10.28 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.007 0.923 . . . . 62.11 110.197 -175.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.44 -22.84 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-N 115.22 -0.9 . . . . 71.5 110.598 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -70.56 -38.14 74.1 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 118.907 -0.568 . . . . 72.2 111.153 171.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.746 ' HE3' ' HA ' ' A' ' 107' ' ' ASP . 10.0 mtmp? -58.92 -47.3 85.49 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 118.536 0.607 . . . . 72.21 110.085 172.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 12.6 mm-40 -58.02 -49.87 75.37 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.329 1.018 . . . . 74.4 110.332 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.415 HD12 ' HB3' ' A' ' 61' ' ' ALA . 0.8 OUTLIER -54.75 -61.72 2.13 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 124.258 0.974 . . . . 71.25 109.727 176.521 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -53.47 -39.59 64.63 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.541 1.136 . . . . 65.55 112.091 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.56 -60.41 3.38 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.969 0.507 . . . . 73.35 111.125 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.519 HD12 HD11 ' A' ' 58' ' ' LEU . 4.1 pp -65.26 -37.16 86.36 Favored 'General case' 0 CA--C 1.559 1.297 0 CA-C-O 120.877 0.37 . . . . 65.5 111.492 -173.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.635 HD21 ' SD ' ' A' ' 122' ' ' MET . 95.1 mt -65.39 -49.11 70.52 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.185 0.994 . . . . 75.45 111.131 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -73.83 -40.06 63.6 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 112.454 0.538 . . . . 72.31 112.454 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 78.9 t -71.5 -53.56 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 122.582 0.353 . . . . 71.35 111.06 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -87.66 -57.68 2.85 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.079 0.466 . . . . 64.43 111.284 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -84.66 -13.2 52.2 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.348 -0.842 . . . . 73.21 111.336 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 60.82 35.32 19.47 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 124.765 1.226 . . . . 74.23 112.016 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.635 ' SD ' HD21 ' A' ' 116' ' ' LEU . 42.4 mtp -78.06 112.77 27.76 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 115.262 -0.881 . . . . 75.34 109.952 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -81.78 105.56 1.55 Allowed 'Trans proline' 0 C--N 1.369 1.647 0 C-N-CA 122.703 2.269 . . . . 75.21 110.637 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 11.6 p -130.98 109.35 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-O 122.091 0.948 . . . . 74.41 110.626 -176.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.3 t -143.78 71.97 17.1 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 115.145 -0.934 . . . . 72.3 109.017 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -91.51 -2.44 4.48 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.322 2.682 . . . . 71.22 113.751 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 40.7 pt -129.85 -155.29 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.189 0.995 . . . . 72.01 109.342 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.6 p -73.17 -155.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.728 0.811 . . . . 74.14 110.899 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -46.12 87.02 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.232 1.013 . . . . 74.41 109.185 170.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.33 -27.91 6.2 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.854 -0.612 . . . . 63.45 112.232 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.25 -42.55 54.91 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.446 -0.575 . . . . 54.52 109.446 172.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 14.5 m -63.23 -18.84 63.97 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.453 1.101 . . . . 75.35 112.366 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -30.73 67.21 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.201 1.4 . . . . 74.11 111.752 -173.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.42 -40.37 57.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.325 0.65 . . . . 71.25 111.282 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -64.24 -39.26 93.59 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.791 0.836 . . . . 75.1 110.668 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -52.16 -57.05 10.81 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 124.6 1.188 . . . . 75.21 110.881 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -69.25 -35.71 76.39 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 124.343 1.027 . . . . 75.3 113.542 -171.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.1 -37.56 69.53 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 118.558 0.617 . . . . 72.44 111.049 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -75.73 -36.35 59.95 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.417 0.627 . . . . 71.02 110.517 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.408 ' O ' ' HB2' ' A' ' 143' ' ' GLU . 14.2 t70 -62.18 -48.49 79.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.235 1.414 . . . . 75.33 109.838 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -74.86 -24.34 58.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.235 -1.348 . . . . 72.31 112.205 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.97 -45.76 93.46 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.861 -0.792 . . . . 75.15 108.861 168.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.408 ' HB2' ' O ' ' A' ' 140' ' ' ASP . 22.2 mm-40 -57.9 -54.16 50.08 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.182 -0.917 . . . . 75.04 111.291 175.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -62.09 -45.44 93.49 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 123.783 0.677 . . . . 72.54 112.5 -176.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -56.59 -54.3 47.53 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.768 0.827 . . . . 74.23 110.886 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -71.9 -30.22 65.14 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.834 -0.621 . . . . 70.02 111.308 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.47 -25.4 59.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.089 0.556 . . . . 72.02 110.957 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -57.8 3.59 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.263 0.625 . . . . 70.33 109.585 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . 0.413 ' NE2' HD23 ' A' ' 89' ' ' LEU . 25.5 mm-40 -62.72 -52.14 64.42 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.352 -0.84 . . . . 64.22 110.65 -175.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 96.0 mmm -100.62 79.33 2.08 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.542 -1.281 . . . . 72.41 107.542 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.401 HD21 ' O ' ' A' ' 155' ' ' ASN . 31.5 tp -82.92 113.69 20.7 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.375 -0.829 . . . . 74.31 109.65 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.5 70.6 1.43 Allowed 'General case' 0 CA--C 1.551 1.001 0 CA-C-O 122.374 1.083 . . . . 72.41 108.937 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -159.74 60.26 0.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 114.934 -1.03 . . . . 73.31 108.34 176.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 56.74 26.92 11.96 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 114.621 -1.172 . . . . 74.41 112.237 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.401 ' O ' HD21 ' A' ' 151' ' ' LEU . 52.6 m-80 68.9 -74.7 0.08 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.548 1.539 . . . . 72.34 111.418 -173.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 118.08 -0.962 . . . . 73.02 110.035 -178.108 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 ttm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 121.233 0.54 . . . . 74.33 110.287 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -69.31 -32.6 71.82 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.536 0.735 . . . . 75.32 110.128 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -70.44 -55.47 8.93 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.701 -0.851 . . . . 73.21 108.701 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.07 -32.21 70.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.145 0.903 . . . . 72.23 112.153 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -61.48 -53.37 57.28 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 109.398 -0.593 . . . . 71.31 109.398 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -67.66 -36.45 80.75 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 123.828 0.705 . . . . 71.02 111.469 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.0 mt -56.89 -54.14 33.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.813 0.845 . . . . 64.24 110.843 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 42.1 mm -67.21 -38.97 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 115.085 -0.961 . . . . 70.42 110.94 -177.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.0 m -62.61 -47.39 83.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.279 0.632 . . . . 71.03 110.552 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.11 -60.63 3.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.659 0.783 . . . . 73.33 110.09 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.78 -41.22 95.85 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 124.515 1.134 . . . . 61.04 113.898 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.419 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 5.9 tp-100 -61.03 -56.15 24.36 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.649 -0.5 . . . . 73.54 109.649 178.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.461 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 85.3 t -62.98 -27.65 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 CA-C-N 115.263 -0.88 . . . . 75.13 111.393 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.465 HD13 ' O ' ' A' ' 69' ' ' LEU . 27.7 mt -60.93 -54.14 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.751 0.82 . . . . 75.21 109.618 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -58.15 -39.97 80.17 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 124.091 0.869 . . . . 74.11 110.508 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.4 mptm? -61.52 -51.43 68.65 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 123.826 0.704 . . . . 74.45 112.408 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 14.7 ptp180 -81.81 -15.71 53.27 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.411 0.523 . . . . 75.22 112.411 -176.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.619 ' SG ' HD22 ' A' ' 31' ' ' LEU . 45.4 t -69.69 -23.52 63.45 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.355 0.662 . . . . 71.24 110.829 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -65.17 -11.06 36.44 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.772 0.429 . . . . 72.51 112.127 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -30.58 71.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.47 0.708 . . . . 74.54 111.849 173.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.2 mmt -67.91 89.42 0.28 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.154 0.502 . . . . 65.44 111.401 -172.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.61 -20.26 61.32 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.709 -1.132 . . . . 74.1 110.574 169.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -121.19 147.82 45.09 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.362 1.065 . . . . 63.35 108.396 177.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.571 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 96.8 m 59.09 59.06 2.88 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 124.812 1.32 . . . . 75.14 110.337 -166.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HG3' ' N ' ' A' ' 26' ' ' LYS . 44.1 pttt -70.29 -40.14 74.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.174 -1.376 . . . . 73.22 111.782 -174.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' N ' ' HG3' ' A' ' 25' ' ' LYS . 60.1 tttm -78.02 -34.83 50.48 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.37 0.268 . . . . 73.15 110.305 -170.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -76.1 -25.48 55.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.339 0.656 . . . . 74.24 111.023 174.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.519 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 38.4 t -69.7 -44.27 70.73 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.743 0.817 . . . . 55.23 110.766 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.84 -33.3 70.52 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.635 0.774 . . . . 75.11 110.484 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.78 -44.33 93.71 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.56 0.744 . . . . 75.13 110.009 175.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.619 HD22 ' SG ' ' A' ' 18' ' ' CYS . 25.5 tp -59.1 -44.88 91.99 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 109.111 -0.699 . . . . 74.34 109.111 172.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.93 -47.53 88.32 Favored Glycine 0 C--N 1.353 1.486 0 O-C-N 124.148 0.905 . . . . 71.34 113.533 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -66.2 -39.68 89.83 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.181 0.592 . . . . 73.04 111.268 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.541 HH12 ' HB2' ' A' ' 106' ' ' SER . 36.5 mtt180 -61.3 -62.01 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.408 0.443 . . . . 72.13 110.478 174.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 64.9 t -53.88 -41.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.627 1.171 . . . . 45.44 112.225 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.467 HD22 HD13 ' A' ' 39' ' ' ILE . 95.9 mt -68.64 -39.82 80.55 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.516 0.326 . . . . 73.42 110.611 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.07 -19.26 65.72 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-N 116.744 -0.207 . . . . 74.11 113.151 173.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.509 HD11 ' O ' ' A' ' 34' ' ' ARG . 5.2 mp -84.41 -53.53 5.39 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.452 1.101 . . . . 73.21 111.103 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.467 HD13 HD22 ' A' ' 36' ' ' LEU . 15.2 pt -83.69 -42.81 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 118.404 -0.808 . . . . 71.34 112.328 -168.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.401 ' O ' ' HG2' ' A' ' 44' ' ' MET . 55.1 mtmt -52.41 -53.23 55.48 Favored Pre-proline 0 N--CA 1.49 1.552 0 CA-C-O 118.116 -0.945 . . . . 73.04 112.853 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.73 -43.22 51.85 Favored 'Trans proline' 0 C--N 1.398 3.146 0 C-N-CA 122.175 1.917 . . . . 74.44 111.7 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.15 -29.08 67.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.322 -0.853 . . . . 72.32 112.081 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 51.1 mt-10 -76.0 -38.06 57.76 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.661 0.785 . . . . 71.34 110.474 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 26.4 mmt -62.63 -36.31 82.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.596 -0.729 . . . . 74.5 110.111 177.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -80.6 -33.73 35.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.719 0.808 . . . . 72.1 111.042 176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.02 -32.93 74.7 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.563 1.145 . . . . 75.03 111.223 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -58.61 -42.13 87.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 124.046 0.842 . . . . 74.33 110.886 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.17 -43.98 69.7 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.619 -0.719 . . . . 74.01 109.721 171.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.47 -71.1 2.87 Favored Glycine 0 C--N 1.348 1.219 0 N-CA-C 111.065 -0.814 . . . . 71.44 111.065 -176.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.578 ' HB3' ' HZ2' ' A' ' 50' ' ' LYS . 8.3 mtpm? 69.94 141.53 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.696 1.598 . . . . 71.01 112.124 175.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.55 86.4 0.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.82 -0.807 . . . . 74.41 108.82 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 12.7 m -114.84 129.17 56.65 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 114.286 -1.325 . . . . 71.1 107.776 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 51.7 t -81.73 112.67 36.5 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 108.721 -0.844 . . . . 73.4 108.721 177.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -72.24 94.18 0.74 Allowed 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.568 2.178 . . . . 74.32 110.497 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.5 t -56.72 151.57 13.85 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.538 -0.756 . . . . 71.44 109.605 175.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.51 -39.47 83.95 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.083 0.553 . . . . 54.52 111.681 -174.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -71.41 -36.03 71.2 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.673 0.789 . . . . 74.21 111.807 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.54 -46.07 87.67 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.211 -1.033 . . . . 75.44 108.211 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.5 m -69.28 -40.27 77.84 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 114.348 -1.296 . . . . 74.44 110.873 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.6 m -60.32 -43.15 96.65 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.268 0.627 . . . . 70.23 110.811 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.64 88.97 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 123.778 0.673 . . . . 64.15 109.998 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.448 ' SD ' HD13 ' A' ' 112' ' ' LEU . 26.3 mmt -64.27 -25.07 67.89 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.266 -0.879 . . . . 75.11 112.362 176.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.54 -44.13 29.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.287 0.635 . . . . 74.44 110.693 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -59.18 -45.09 91.94 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.875 0.734 . . . . 74.45 109.401 175.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -61.18 -50.76 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 113.245 -1.798 . . . . 65.34 110.746 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -58.56 -48.65 80.22 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.939 1.296 . . . . 75.14 110.624 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.28 -39.39 93.84 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.351 0.661 . . . . 74.2 111.743 -177.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.414 ' HB3' HD12 ' A' ' 105' ' ' LEU . . . -69.72 -34.3 73.69 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.707 -0.679 . . . . 72.22 110.911 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.465 ' O ' HD13 ' A' ' 14' ' ' ILE . 89.8 mt -69.48 -34.09 73.84 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.732 0.413 . . . . 74.02 110.74 174.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.77 -40.57 97.0 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.834 0.35 . . . . 74.51 110.751 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.88 -39.97 87.67 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.67 -0.695 . . . . 71.13 111.175 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.26 -39.32 89.39 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.258 0.623 . . . . 75.42 110.998 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -62.43 -44.56 96.13 Favored 'General case' 0 C--N 1.351 0.65 0 O-C-N 124.565 1.166 . . . . 73.52 109.38 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.6 -36.8 93.82 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.781 -0.645 . . . . 72.52 112.957 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.34 -52.93 63.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.69 0.396 . . . . 74.01 110.884 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.411 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.3 OUTLIER -66.75 -26.48 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 112.73 0.641 . . . . 73.42 112.73 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.35 -36.02 82.32 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.087 0.47 . . . . 64.55 111.163 170.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -76.74 -38.56 54.0 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.733 0.813 . . . . 74.41 111.024 175.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.411 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-85 -80.18 -0.86 37.92 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.871 0.868 . . . . 73.23 113.033 -173.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 p -58.2 -29.28 65.55 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.054 0.454 . . . . 73.42 110.608 169.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -82.29 110.35 17.38 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 115.086 -0.961 . . . . 71.25 108.76 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -69.85 -31.73 69.73 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.775 0.83 . . . . 75.54 111.122 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.0 p -67.73 -37.85 82.74 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.151 0.98 . . . . 62.23 111.18 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -61.76 -38.48 88.17 Favored 'General case' 0 C--O 1.25 1.114 0 C-N-CA 123.456 0.702 . . . . 75.25 111.05 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.483 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 22.6 mt -59.84 -49.7 82.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 CA-C-N 115.529 -0.759 . . . . 75.11 109.724 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.8 t -62.15 -35.06 77.63 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.222 0.609 . . . . 64.43 111.562 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -64.33 -47.72 78.31 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 124.055 0.847 . . . . 72.42 111.268 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.77 -32.44 59.94 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 110.002 -0.369 . . . . 74.25 110.002 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 9.7 tp -61.96 -50.62 71.39 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 124.184 0.994 . . . . 73.04 110.033 -174.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -61.23 -29.01 69.57 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 115.932 -0.576 . . . . 75.14 112.25 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.2 -54.48 6.44 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.355 0.662 . . . . 64.21 111.356 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -99.07 115.14 28.31 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.61 0.764 . . . . 74.44 109.622 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . 0.466 ' HA ' ' CZ ' ' A' ' 145' ' ' ARG . 50.2 mt-30 -80.06 -46.48 16.46 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 112.88 0.696 . . . . 63.24 112.88 -170.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.17 -23.28 35.62 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.164 0.586 . . . . 71.41 111.098 -176.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -62.16 114.73 3.6 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 124.313 1.008 . . . . 73.32 110.841 -169.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.483 HG13 ' HB2' ' A' ' 141' ' ' ALA . 3.0 mp -61.71 157.39 3.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 CA-C-N 114.311 -1.313 . . . . 75.12 107.551 171.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.8 -31.4 62.61 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.855 0.862 . . . . 61.52 112.049 -173.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.409 ' CZ ' HD23 ' A' ' 31' ' ' LEU . 91.2 m-85 -125.57 25.54 6.97 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.107 -0.949 . . . . 72.52 110.694 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.28 -64.02 0.35 Allowed 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 125.488 1.515 . . . . 73.12 113.607 -163.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -67.31 -48.87 66.32 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.129 0.972 . . . . 73.52 111.553 -170.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.06 -43.38 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 114.765 -1.107 . . . . 75.51 110.875 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.491 ' HA ' ' HB2' ' A' ' 105' ' ' LEU . 67.3 t30 -78.34 -18.32 55.32 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.986 1.315 . . . . 73.35 110.212 -176.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.05 -39.78 72.07 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.746 -1.205 . . . . 73.14 107.746 168.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.73 -39.69 94.07 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.516 0.51 . . . . 72.41 110.523 170.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.491 ' HB2' ' HA ' ' A' ' 102' ' ' ASN . 9.4 mp -60.07 -43.92 95.11 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 109.766 -0.457 . . . . 73.33 109.766 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.541 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.4 t -66.04 -47.5 74.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.116 0.566 . . . . 70.13 110.789 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.35 -57.35 7.65 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.642 1.177 . . . . 75.54 110.966 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.8 t -63.52 -39.85 86.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-N 115.566 -0.743 . . . . 72.04 111.258 -177.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.2 t-105 -69.37 -39.05 78.29 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-O 118.543 -0.741 . . . . 74.41 111.88 -178.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -38.47 83.63 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 119.4 1.0 . . . . 74.4 110.534 175.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -60.5 -46.58 89.58 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.03 0.532 . . . . 73.25 110.903 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 8.4 tt -70.39 -48.2 57.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.595 1.158 . . . . 73.41 109.936 -172.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.1 p -65.63 -43.1 90.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.724 0.81 . . . . 74.5 110.891 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.472 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.7 mt -68.87 -35.33 76.77 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.234 -0.413 . . . . 72.42 112.041 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.67 -21.78 59.23 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-N 118.705 0.684 . . . . 75.43 110.896 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.0 mt -70.93 -35.33 72.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.916 -0.401 . . . . 75.1 109.916 167.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -29.81 65.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.73 0.812 . . . . 72.53 111.662 176.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 t -85.2 -62.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 122.728 0.411 . . . . 74.03 110.957 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -75.93 -56.14 4.95 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.203 0.601 . . . . 73.15 111.687 -170.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -85.12 -18.24 34.83 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.177 0.591 . . . . 74.12 110.808 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 61.52 16.22 7.41 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.63 1.572 . . . . 74.55 112.798 -177.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 36.6 mtm -71.84 140.83 83.94 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.522 -0.547 . . . . 73.32 109.522 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -81.0 35.65 0.59 Allowed 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 123.499 2.799 . . . . 74.43 112.813 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.9 t -91.08 93.06 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.397 -0.964 . . . . 74.23 108.397 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 23.0 t -158.65 77.37 3.27 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 123.304 0.641 . . . . 64.1 110.037 171.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -85.36 38.42 0.64 Allowed 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 123.503 2.802 . . . . 74.21 112.086 173.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 12.7 tt -159.11 -50.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-N 115.827 -0.624 . . . . 70.41 110.604 -174.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 66.2 m 46.49 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.657 1.583 . . . . 73.55 113.474 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.612 HE21 ' HB2' ' A' ' 131' ' ' ALA . 17.3 pt20 -72.16 -40.91 67.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.347 0.659 . . . . 75.21 111.353 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 81.0 -7.88 58.67 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.754 -0.47 . . . . 55.31 114.013 -176.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.612 ' HB2' HE21 ' A' ' 129' ' ' GLN . . . -64.39 -37.85 88.95 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.674 0.79 . . . . 64.21 110.868 177.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.44 ' O ' ' HG3' ' A' ' 136' ' ' GLU . 33.9 p -57.54 -55.62 32.53 Favored 'General case' 0 C--N 1.35 0.628 0 O-C-N 124.293 0.995 . . . . 72.34 110.25 173.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.9 m0 -53.96 -41.96 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.568 1.147 . . . . 74.3 113.077 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.44 -37.11 82.48 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 122.785 0.434 . . . . 73.02 111.877 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -74.58 -43.58 54.95 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.904 0.482 . . . . 74.14 111.269 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 132' ' ' SER . 44.7 mt-10 -63.07 -53.71 49.46 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.502 0.721 . . . . 63.55 110.976 -174.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.83 -29.73 68.46 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.541 0.737 . . . . 74.21 112.461 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -71.52 -45.25 62.9 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 123.757 0.661 . . . . 74.03 110.729 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -68.27 -35.75 78.37 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.026 -0.533 . . . . 73.31 110.548 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.47 -45.0 81.17 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.39 -0.823 . . . . 74.31 109.043 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.483 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -57.69 -40.89 80.47 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 124.272 0.982 . . . . 62.33 111.181 178.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.77 -60.6 3.27 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 124.084 0.865 . . . . 72.43 110.903 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.76 -46.73 86.8 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.261 1.024 . . . . 74.24 111.689 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -78.58 -27.22 45.64 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.185 -1.371 . . . . 74.53 110.84 -170.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.466 ' CZ ' ' HA ' ' A' ' 93' ' ' GLN . 57.0 ttt85 -61.68 -47.8 83.68 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 115.939 -0.573 . . . . 73.4 109.681 167.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -62.84 -37.3 86.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.766 0.666 . . . . 62.43 110.688 176.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.45 -20.91 62.86 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.779 0.675 . . . . 75.1 111.684 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.571 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -84.85 -62.45 1.54 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.804 0.275 . . . . 73.5 110.552 172.225 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -68.26 -24.3 64.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.432 1.093 . . . . 64.43 111.485 -166.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 44.0 ttm -139.57 83.22 1.92 Allowed 'General case' 0 C--O 1.24 0.554 0 N-CA-C 107.378 -1.342 . . . . 65.31 107.378 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 1.3 tt -70.57 82.94 0.6 Allowed 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.614 -0.721 . . . . 75.42 109.303 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -158.43 83.71 0.84 Allowed 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.771 -1.196 . . . . 75.41 107.771 -177.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -170.64 -46.53 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.415 -1.328 . . . . 72.34 107.415 -172.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -165.19 136.58 4.06 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 113.689 -1.596 . . . . 70.42 108.427 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -145.02 173.12 12.16 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.711 0.804 . . . . 74.03 109.909 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 . . . . . 0 CA--C 1.549 0.942 0 C-N-CA 123.822 0.849 . . . . 65.25 109.827 -176.74 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.2 ttp . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 110.622 -0.14 . . . . 72.45 110.622 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.47 -22.28 54.2 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.43 0.692 . . . . 63.11 111.559 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.19 -57.35 11.49 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.604 1.162 . . . . 64.44 108.776 171.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.94 -44.25 97.15 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 114.961 -1.018 . . . . 72.51 110.5 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -58.31 -51.19 70.84 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.571 0.545 . . . . 73.43 111.07 -175.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.517 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 22.0 m-70 -67.9 -52.1 40.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.032 0.533 . . . . 75.12 111.182 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.8 mt -53.61 -50.21 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 124.12 0.968 . . . . 75.12 111.86 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.441 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 99.6 mt -63.68 -46.44 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.545 -0.74 . . . . 74.32 109.667 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -51.63 -44.17 62.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 123.754 0.659 . . . . 65.42 110.571 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 84.6 mt -59.85 -50.9 71.99 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.729 0.643 . . . . 74.3 110.307 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.78 -33.82 87.0 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 124.385 1.053 . . . . 73.33 113.629 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.468 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 19.3 mm-40 -64.9 -52.79 54.59 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.668 -0.864 . . . . 71.54 108.668 176.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.71 -34.63 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.354 1.062 . . . . 75.43 110.946 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.71 -51.6 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 123.983 0.913 . . . . 74.24 109.736 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -64.06 -36.4 83.88 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.815 0.697 . . . . 73.54 110.346 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.1 mmmt -79.65 -29.05 40.84 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.352 0.661 . . . . 65.34 112.653 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.402 ' O ' ' HG2' ' A' ' 20' ' ' GLU . 11.6 ptm180 -87.98 -20.97 25.14 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.219 -0.301 . . . . 74.44 110.756 174.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.475 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 36.5 t -74.05 -20.26 60.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.781 0.832 . . . . 75.1 110.927 175.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -48.85 -36.43 16.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.832 0.853 . . . . 75.4 112.402 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.457 ' HB2' ' NH2' ' A' ' 82' ' ' ARG . 12.8 pt-20 -76.83 -3.37 38.1 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.464 0.913 . . . . 75.13 113.464 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 18.6 mmt -74.98 83.91 2.25 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.64 -0.504 . . . . 65.15 109.64 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -70.1 -36.45 74.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.929 -0.767 . . . . 73.33 108.929 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -95.86 158.26 15.53 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.743 -1.117 . . . . 73.34 109.215 168.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.691 ' SG ' HG23 ' A' ' 85' ' ' ILE . 91.8 m 56.51 58.96 3.84 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 124.237 0.961 . . . . 74.44 109.934 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -70.53 -49.4 48.56 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 113.675 -1.602 . . . . 72.22 110.379 -171.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 52.4 mttm -70.58 -38.93 74.14 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.027 -0.988 . . . . 74.23 110.995 -174.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.27 -26.34 61.95 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.29 0.636 . . . . 74.11 111.337 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.475 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 49.7 t -69.46 -37.48 77.33 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.42 0.688 . . . . 74.54 110.311 170.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.89 -34.23 68.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.548 -0.751 . . . . 74.52 110.573 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' NH1' ' HB3' ' A' ' 136' ' ' GLU . 29.0 mmt180 -69.2 -60.58 2.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.913 0.485 . . . . 73.2 109.985 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.7 tp -54.79 -49.35 71.16 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.857 0.723 . . . . 75.1 110.146 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.11 -55.48 30.09 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 124.059 0.849 . . . . 74.3 113.548 -176.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -67.94 -36.83 80.81 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.882 0.873 . . . . 74.43 110.996 -175.069 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.493 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 42.3 mtt-85 -63.42 -62.41 1.7 Allowed 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.822 0.701 . . . . 74.3 110.704 176.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 87.1 t -54.06 -46.76 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.041 0.936 . . . . 74.23 110.989 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.92 -38.43 90.96 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.228 -0.896 . . . . 70.11 109.708 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -75.71 -13.24 83.21 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 115.539 -0.755 . . . . 71.45 113.738 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 65.6 mt -84.09 -44.93 13.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.137 0.575 . . . . 75.24 110.003 174.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 pt -85.97 -24.43 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-N 115.498 -0.774 . . . . 71.4 112.407 -172.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -62.05 -47.28 91.1 Favored Pre-proline 0 N--CA 1.497 1.899 0 N-CA-C 112.899 0.703 . . . . 74.21 112.899 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.65 -51.48 11.02 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 121.758 1.639 . . . . 75.33 110.447 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.07 -19.61 64.89 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.296 -0.866 . . . . 72.32 111.772 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -68.1 -55.34 12.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.351 0.66 . . . . 63.2 110.013 174.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 50.7 mtm -64.65 -35.31 80.62 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.908 -1.042 . . . . 73.32 110.166 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.557 HD13 ' SD ' ' A' ' 122' ' ' MET . 68.3 mt -82.02 -18.92 41.63 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.76 1.224 . . . . 74.32 111.838 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -75.43 -43.1 51.53 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.454 -0.572 . . . . 72.32 109.454 172.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -55.51 -45.28 77.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.788 -1.096 . . . . 75.12 110.231 177.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -78.26 -37.95 43.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.838 -1.074 . . . . 73.43 110.809 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.6 52.93 4.52 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.58 -0.736 . . . . 74.33 112.4 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -69.33 108.96 3.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.06 0.944 . . . . 74.13 110.264 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.6 mtm180 70.87 24.67 4.06 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 125.654 1.582 . . . . 74.22 112.009 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -61.4 129.56 41.81 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.658 0.383 . . . . 74.42 110.632 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 44.6 t -84.63 113.24 47.99 Favored Pre-proline 0 CA--C 1.55 0.971 0 O-C-N 124.241 0.963 . . . . 75.01 110.215 -177.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -82.22 151.0 15.69 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 123.189 2.592 . . . . 74.33 111.344 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.2 p -77.05 -179.73 5.74 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.979 0.512 . . . . 73.24 110.495 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.14 -34.48 68.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.193 0.597 . . . . 71.33 110.136 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -59.35 -51.49 69.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.819 0.848 . . . . 73.4 110.27 170.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 115' ' ' LEU . 0.7 OUTLIER -54.96 -46.36 75.02 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.427 -1.26 . . . . 64.52 110.26 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 94.2 m -58.68 -46.83 86.37 Favored 'General case' 0 C--N 1.356 0.863 0 C-N-CA 124.025 0.93 . . . . 74.53 110.537 -178.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.1 m -61.88 -50.26 72.95 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.982 0.801 . . . . 74.44 110.352 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.441 ' HA ' ' HD3' ' A' ' 64' ' ' ARG . . . -59.78 -40.47 88.35 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.949 0.899 . . . . 72.3 111.407 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.436 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.4 mmt -66.58 -35.59 80.59 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.481 -0.781 . . . . 75.11 110.842 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -71.7 -35.66 70.31 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.278 0.631 . . . . 74.53 111.039 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.441 ' HD3' ' HA ' ' A' ' 61' ' ' ALA . 66.8 mtp85 -68.38 -41.13 81.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.072 0.949 . . . . 73.41 110.086 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -71.93 -41.2 68.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.64 -1.163 . . . . 73.25 110.023 -177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 1.2 tmtp? -59.78 -48.35 82.02 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.092 1.357 . . . . 72.4 109.066 175.133 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.518 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -61.52 -40.66 95.44 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 124.538 1.149 . . . . 73.54 110.909 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.548 ' HB2' HD11 ' A' ' 105' ' ' LEU . . . -64.37 -36.1 83.04 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.698 0.799 . . . . 64.32 110.747 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -73.06 -27.69 61.88 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.282 0.633 . . . . 71.24 111.57 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 13.1 mm-40 -64.72 -41.55 95.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.338 -0.616 . . . . 75.54 109.338 172.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 5.0 mm-40 -59.48 -49.01 79.46 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-N 115.119 -0.946 . . . . 73.3 110.333 177.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.52 -47.48 85.38 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.957 0.786 . . . . 74.21 111.572 -178.812 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.88 -48.75 80.3 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 124.4 1.063 . . . . 73.11 111.174 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.402 ' O ' ' HG2' ' A' ' 78' ' ' LYS . . . -61.35 -38.74 96.21 Favored Glycine 0 C--N 1.351 1.378 0 O-C-N 124.026 0.829 . . . . 31.41 112.815 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -62.89 -56.78 14.25 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 118.765 -0.636 . . . . 73.21 111.135 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.567 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.8 OUTLIER -63.49 -23.06 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 122.756 0.423 . . . . 75.23 112.053 177.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.47 -38.05 80.71 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.675 0.39 . . . . 73.5 110.262 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 74' ' ' GLY . 31.5 mmtp -83.9 -29.5 27.13 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.453 0.301 . . . . 72.43 111.129 176.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.567 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.8 m-85 -77.46 -8.52 57.88 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.319 1.048 . . . . 72.14 111.335 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.1 p -56.37 -30.41 62.64 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.214 0.606 . . . . 74.24 109.889 171.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -81.21 102.13 10.14 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.54 -1.281 . . . . 71.33 107.54 165.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.538 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.6 mpt_? -70.32 -24.89 63.09 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.749 0.82 . . . . 71.12 110.535 -175.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 72.4 p -66.89 -40.98 87.93 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.947 0.899 . . . . 54.5 110.478 172.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -57.86 -42.29 84.2 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.011 0.924 . . . . 74.12 110.65 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.691 HG23 ' SG ' ' A' ' 24' ' ' CYS . 15.7 mt -58.81 -57.45 11.16 Favored 'Isoleucine or valine' 0 C--N 1.356 0.889 0 CA-C-N 115.323 -0.853 . . . . 75.24 109.379 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.4 t -53.77 -37.09 63.08 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.766 0.827 . . . . 71.0 112.146 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -60.67 -45.71 93.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.832 1.253 . . . . 75.1 111.277 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -25.95 29.65 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.408 0.147 . . . . 75.32 110.78 176.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.472 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 13.4 tp -78.01 -29.21 49.42 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.572 0.749 . . . . 75.21 111.635 -167.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -72.76 -26.62 61.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.114 0.566 . . . . 75.01 110.214 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.13 -37.27 20.42 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.018 0.927 . . . . 74.14 110.369 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.572 ' HB2' ' HB2' ' A' ' 95' ' ' LYS . 79.2 p -79.13 133.73 36.73 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.108 0.563 . . . . 63.34 110.384 -178.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -94.97 -43.08 8.32 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.759 0.824 . . . . 74.32 110.853 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -146.7 11.19 1.09 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.51 0.724 . . . . 73.42 110.96 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.572 ' HB2' ' HB2' ' A' ' 92' ' ' SER . 99.4 mttt -67.16 89.03 0.18 Allowed 'General case' 0 C--N 1.354 0.761 0 N-CA-C 108.104 -1.073 . . . . 72.24 108.104 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.405 HD12 ' HB2' ' A' ' 141' ' ' ALA . 16.3 mm -57.28 137.87 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.923 -1.139 . . . . 71.3 107.923 177.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.3 mp -45.33 -38.52 5.84 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.198 0.999 . . . . 73.53 112.488 -177.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -125.65 39.31 3.99 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 123.924 0.89 . . . . 73.52 109.797 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -56.55 -58.47 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.755 0.707 . . . . 74.11 111.399 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.32 -47.89 53.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.523 1.129 . . . . 72.11 110.229 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.71 -63.53 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.605 0 O-C-N 124.372 1.045 . . . . 72.34 110.933 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -65.9 -28.03 68.64 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.774 1.23 . . . . 74.11 111.475 -176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -57.66 -46.87 83.68 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 110.02 -0.363 . . . . 74.41 110.02 169.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -67.36 -32.55 73.56 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.189 0.596 . . . . 75.41 111.944 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 68' ' ' ALA . 11.0 mp -60.7 -47.92 84.09 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 110.012 -0.366 . . . . 75.04 110.012 171.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.7 m -68.46 -39.67 81.34 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.048 0.939 . . . . 64.05 111.323 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.528 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 9.5 t0 -68.0 -58.41 4.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.468 -1.242 . . . . 65.44 109.151 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.5 t -65.15 -33.93 67.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.449 -0.796 . . . . 73.12 110.348 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 49.3 t-105 -60.62 -44.09 96.73 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 119.187 -0.435 . . . . 74.53 111.479 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.528 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 19.1 pttm -64.61 -43.85 92.46 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.987 -0.745 . . . . 74.41 108.987 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.7 mt-10 -61.05 -42.57 98.73 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.696 0.799 . . . . 72.12 110.747 178.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.436 HD11 ' SD ' ' A' ' 62' ' ' MET . 7.0 tt -71.41 -48.47 49.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.966 1.306 . . . . 74.42 109.785 -171.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 39.3 t -61.0 -34.66 75.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.418 1.087 . . . . 74.21 110.922 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -63.9 -58.47 6.68 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 123.043 0.537 . . . . 75.4 111.502 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.554 HD11 HD23 ' A' ' 58' ' ' LEU . 2.0 pp -67.31 -20.26 65.58 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 118.569 0.622 . . . . 70.21 112.164 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.626 HD13 ' SD ' ' A' ' 122' ' ' MET . 46.7 mt -64.01 -55.27 23.54 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.747 0.419 . . . . 72.55 110.635 167.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.22 -26.49 62.96 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.052 0.389 . . . . 74.3 112.052 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 79.3 t -78.42 -54.33 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.418 0.687 . . . . 75.43 110.517 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -90.15 -59.14 2.27 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.075 0.398 . . . . 73.23 112.075 -172.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -77.25 -14.44 59.76 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 122.721 0.408 . . . . 74.3 110.944 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.14 54.69 6.61 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.904 1.281 . . . . 64.44 108.858 -175.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.626 ' SD ' HD13 ' A' ' 116' ' ' LEU . 51.0 ttm -92.24 131.0 35.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 108.414 -0.958 . . . . 75.31 108.414 174.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 2.7 Cg_exo -76.52 22.78 0.51 Allowed 'Trans proline' 0 C--N 1.371 1.753 0 C-N-CA 122.958 2.438 . . . . 74.41 113.61 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 13.9 p -76.04 109.5 9.91 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.541 0.736 . . . . 64.24 110.598 -175.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 66.7 m -151.46 76.07 7.71 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 107.702 -1.222 . . . . 72.04 107.702 166.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -82.52 -16.49 8.01 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 122.354 2.036 . . . . 72.35 111.714 175.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 11.4 tt -126.97 144.94 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.626 1.17 . . . . 71.03 109.329 -175.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 39.1 p -76.32 -61.91 1.79 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.57 0.748 . . . . 75.24 110.259 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -159.4 -12.26 0.06 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.352 0.661 . . . . 74.44 112.276 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.426 ' HA2' ' HB2' ' A' ' 133' ' ' TRP . . . 95.52 16.22 40.67 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-O 120.023 -0.32 . . . . 53.32 112.951 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.47 -52.06 55.7 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.791 0.837 . . . . 61.13 110.835 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.2 m -73.55 -30.86 63.32 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.242 -0.89 . . . . 62.44 110.787 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.426 ' HB2' ' HA2' ' A' ' 130' ' ' GLY . 0.1 OUTLIER -60.01 -43.61 95.1 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.185 0.994 . . . . 73.33 111.7 -179.175 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.11 -41.38 92.48 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.499 0.719 . . . . 72.33 111.216 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.433 ' HA ' HE21 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -72.03 -45.14 61.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.897 0.879 . . . . 71.5 111.464 -178.581 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.444 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 19.0 mm-40 -50.1 -55.95 12.85 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.656 1.182 . . . . 64.12 111.449 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 -52.18 45.84 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 114.467 -1.242 . . . . 73.31 111.979 -174.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.74 -40.08 91.06 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 118.247 0.476 . . . . 74.42 111.289 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -53.16 19.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.409 0.684 . . . . 74.25 109.237 -177.227 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.89 -34.87 78.73 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.911 -1.04 . . . . 70.22 110.234 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 96' ' ' ILE . . . -72.03 -31.93 66.64 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.103 0.961 . . . . 64.42 111.215 179.25 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -65.06 -47.26 77.97 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 123.738 0.649 . . . . 65.02 110.327 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.36 -33.8 75.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.768 -0.651 . . . . 74.32 111.593 174.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.7 t0 -72.58 -41.96 65.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.231 1.012 . . . . 71.24 111.521 -178.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.472 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 26.8 ttp85 -60.76 -43.23 98.27 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 114.855 -1.066 . . . . 75.11 109.128 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 13.7 ttp-105 -66.71 -33.92 76.7 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.972 -1.013 . . . . 74.41 111.548 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.4 -27.61 66.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.452 0.301 . . . . 73.4 111.101 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -47.64 10.57 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.198 0.599 . . . . 75.32 110.653 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -80.99 -41.63 22.44 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.67 0.788 . . . . 74.55 112.43 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 49.1 ttm -76.73 -61.0 2.11 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.515 -1.291 . . . . 75.22 107.515 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.408 ' HG ' ' H ' ' A' ' 153' ' ' ARG . 18.5 tp 65.01 163.66 0.15 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.705 1.202 . . . . 75.24 112.207 175.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 21.0 ttm-85 -160.64 33.88 0.16 Allowed 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.852 0.834 . . . . 73.35 109.24 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.408 ' H ' ' HG ' ' A' ' 151' ' ' LEU . 1.5 tpm_? -122.28 174.52 6.94 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.468 1.107 . . . . 74.34 109.123 -176.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -53.56 126.02 20.2 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.825 0.85 . . . . 74.31 111.866 -177.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.401 ' N ' HD21 ' A' ' 155' ' ' ASN . 0.0 OUTLIER -156.81 -166.27 2.06 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 124.182 0.993 . . . . 75.53 109.261 -170.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 . . . . . 0 CA--C 1.562 1.417 0 C-N-CA 123.289 0.636 . . . . 73.24 111.116 -179.843 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.543 ' HG3' ' H ' ' A' ' 2' ' ' GLU . 12.6 ptm . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 110.745 -0.095 . . . . 74.22 110.745 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.543 ' H ' ' HG3' ' A' ' 1' ' ' MET . 3.5 tm-20 -80.08 -48.06 13.84 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.2 -1.037 . . . . 75.01 108.2 -176.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.538 ' HA ' ' HD2' ' A' ' 66' ' ' LYS . 5.1 p30 -55.76 -43.99 77.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.471 -1.24 . . . . 61.52 111.14 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.451 HD21 HD12 ' A' ' 7' ' ' ILE . 29.2 mt -65.55 -33.44 75.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.529 0.731 . . . . 72.41 111.789 175.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 tmtp? -60.7 -44.92 95.97 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 107.973 -1.121 . . . . 75.24 107.973 177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -68.72 -40.14 80.08 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.858 -0.61 . . . . 74.1 111.915 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.451 HD12 HD21 ' A' ' 4' ' ' LEU . 83.9 mt -58.9 -53.14 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.394 0.678 . . . . 74.14 110.612 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.73 HG21 ' HG2' ' A' ' 43' ' ' GLU . 30.6 mm -70.29 -53.68 22.0 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-N 115.413 -0.812 . . . . 72.43 110.806 -174.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 92.1 m -60.41 -58.96 6.27 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 123.834 0.709 . . . . 73.15 110.848 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.428 ' O ' HG13 ' A' ' 14' ' ' ILE . 95.0 mt -66.48 -32.41 73.76 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 118.644 -0.693 . . . . 75.03 111.748 -175.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.438 ' HA2' HD13 ' A' ' 14' ' ' ILE . . . -63.09 -43.01 99.39 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 121.387 -0.435 . . . . 71.02 112.473 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.02 -38.77 79.39 Favored 'General case' 0 CA--C 1.552 1.026 0 O-C-N 122.427 -0.455 . . . . 72.04 110.647 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 73.0 t -64.32 -34.85 71.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.554 0.742 . . . . 72.01 110.386 175.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.464 HG22 HG23 ' A' ' 35' ' ' VAL . 54.8 mt -56.85 -52.81 50.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.669 0.787 . . . . 72.23 109.152 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -58.96 -33.05 70.19 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 123.998 0.811 . . . . 74.12 111.522 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -67.48 -57.65 6.15 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.549 0.739 . . . . 71.13 112.023 176.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 15.0 ptp180 -82.53 -15.55 51.96 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 113.015 0.746 . . . . 75.13 113.015 -172.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.599 ' SG ' HD23 ' A' ' 31' ' ' LEU . 49.2 t -68.98 -28.37 66.55 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.097 0.408 . . . . 72.11 111.967 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -5.26 58.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.458 0.303 . . . . 74.12 111.71 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.86 -39.43 89.12 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 123.412 0.685 . . . . 74.12 109.608 172.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.628 ' SD ' ' HA ' ' A' ' 80' ' ' SER . 3.3 mpp? -64.7 104.29 0.8 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.389 -0.823 . . . . 75.51 109.658 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -31.78 71.15 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.526 0.73 . . . . 75.55 109.398 172.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.47 ' O ' ' HB3' ' A' ' 21' ' ' MET . 87.2 m-85 -91.89 169.68 10.48 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.577 -1.192 . . . . 74.51 109.017 170.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.632 ' SG ' HG23 ' A' ' 85' ' ' ILE . 56.7 m 56.41 56.24 5.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.255 1.026 . . . . 73.11 110.204 -172.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.87 -47.13 66.68 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.564 -1.653 . . . . 74.45 109.961 -174.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.653 ' HZ1' ' HA ' ' A' ' 140' ' ' ASP . 4.1 mtpm? -82.0 -17.72 45.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.889 -1.05 . . . . 74.52 109.824 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.671 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 10.7 mm-40 -70.62 -38.82 73.98 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 110.324 -0.25 . . . . 73.14 110.324 168.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.534 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 52.5 t -67.52 -32.92 74.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.843 0.715 . . . . 75.31 110.041 174.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -62.44 -62.98 1.38 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.772 0.429 . . . . 75.41 111.854 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -41.21 94.29 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.627 0.371 . . . . 75.44 111.875 -176.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.599 HD23 ' SG ' ' A' ' 18' ' ' CYS . 60.1 tp -65.24 -59.61 3.88 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.586 0.354 . . . . 71.23 110.074 179.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.48 -40.77 92.77 Favored Glycine 0 C--N 1.345 1.046 0 O-C-N 124.41 1.068 . . . . 70.51 113.459 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -65.69 -49.34 68.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.522 0.729 . . . . 62.32 111.102 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.532 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 55.3 mtt-85 -57.09 -58.41 8.31 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.859 0.725 . . . . 74.3 110.147 175.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.464 HG23 HG22 ' A' ' 14' ' ' ILE . 54.5 t -52.1 -45.99 42.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 124.048 0.939 . . . . 72.21 111.672 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.18 -45.75 93.32 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.438 0.461 . . . . 72.41 110.878 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.51 -24.45 69.4 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 123.164 0.29 . . . . 63.02 113.647 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.604 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 30.2 mt -85.86 -51.6 6.29 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 123.488 0.715 . . . . 73.54 111.401 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.427 HG22 ' HA3' ' A' ' 11' ' ' GLY . 17.0 pt -72.66 -40.81 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.422 -0.799 . . . . 75.3 111.214 -173.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.44 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 23.8 tptm -51.33 -50.54 75.53 Favored Pre-proline 0 N--CA 1.49 1.571 0 N-CA-C 113.778 1.029 . . . . 72.52 113.778 -170.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 51.0 Cg_exo -57.48 -41.57 70.49 Favored 'Trans proline' 0 C--N 1.387 2.595 0 C-N-CA 121.726 1.617 . . . . 64.0 112.569 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.98 -25.51 59.97 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.185 -0.916 . . . . 74.24 111.218 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.73 ' HG2' HG21 ' A' ' 8' ' ' ILE . 38.5 mt-10 -67.69 -44.03 78.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.034 0.934 . . . . 73.32 109.562 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.425 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 30.3 mmt -59.69 -47.35 85.97 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 124.701 1.25 . . . . 74.43 110.165 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.2 -30.92 63.85 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.716 0.806 . . . . 74.21 112.071 -177.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.53 -29.86 61.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.94 0.896 . . . . 74.25 109.679 177.048 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.04 -50.43 13.13 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.623 0.769 . . . . 74.35 109.94 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 44' ' ' MET . 30.6 mm-40 -63.05 -52.9 60.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.538 0.735 . . . . 73.32 109.708 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -101.53 -138.24 10.08 Favored Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.199 -0.76 . . . . 64.21 111.199 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.522 ' HZ1' ' HB2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -177.99 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.859 0.863 . . . . 74.11 109.312 176.343 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -74.56 117.25 16.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.235 -0.893 . . . . 71.12 109.904 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.412 ' OG ' HD12 ' A' ' 4' ' ' LEU . 3.2 m -76.69 155.73 33.11 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 123.311 0.644 . . . . 64.31 109.993 -179.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.45 77.47 54.32 Favored Pre-proline 0 CA--C 1.557 1.216 0 N-CA-C 108.231 -1.026 . . . . 70.21 108.231 170.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.446 ' HA ' HD23 ' A' ' 58' ' ' LEU . 62.1 Cg_endo -97.88 160.64 0.87 Allowed 'Trans proline' 0 C--N 1.378 2.115 0 C-N-CA 123.144 2.563 . . . . 74.12 113.385 -175.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -77.58 173.93 11.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 162.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.13 -43.39 98.54 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.335 0.654 . . . . 74.11 110.485 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? -74.77 -21.97 59.03 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.831 -0.622 . . . . 73.33 112.147 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.8 HD12 HD13 ' A' ' 115' ' ' LEU . 13.0 tp -81.22 -30.69 34.17 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.29 0.636 . . . . 74.41 110.316 174.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.8 m -63.45 -45.35 91.29 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.435 -0.95 . . . . 74.25 108.435 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.466 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 57.2 m -60.58 -44.25 96.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 124.401 1.063 . . . . 72.24 111.244 174.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.51 -42.99 98.46 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.6 0.76 . . . . 61.12 111.275 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.45 -30.67 69.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.164 0.586 . . . . 62.04 111.042 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -74.15 -32.92 63.33 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.133 0.573 . . . . 70.14 111.164 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.8 mtt180 -65.21 -47.1 78.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 109.143 -0.688 . . . . 75.25 109.143 175.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.604 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 4.5 t80 -65.51 -45.49 83.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.673 -1.603 . . . . 75.41 109.772 -175.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.538 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 34.4 tttm -49.67 -57.71 6.7 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 113.915 -1.493 . . . . 75.31 110.269 169.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.408 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -62.91 -31.47 72.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.704 0.802 . . . . 73.05 111.824 -176.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.496 ' HB2' HD12 ' A' ' 105' ' ' LEU . . . -70.0 -37.75 75.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.911 0.884 . . . . 73.21 111.164 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.03 -21.14 40.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.152 0.581 . . . . 75.52 110.541 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.445 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 78.1 mt-10 -72.55 -38.13 68.07 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.352 0.661 . . . . 63.05 110.05 171.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.479 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 48.3 mt-10 -64.67 -50.21 67.94 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.696 -0.684 . . . . 74.21 109.381 174.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -57.07 -48.18 79.2 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.279 0.987 . . . . 72.13 111.71 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -56.54 -42.73 78.98 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.436 1.085 . . . . 73.41 110.704 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.24 -36.49 89.84 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.646 0.592 . . . . 64.21 113.218 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.2 mm-40 -63.08 -55.51 24.83 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.941 -0.392 . . . . 71.34 109.941 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.628 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.3 pt -69.03 -20.18 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.366 0.666 . . . . 75.14 112.404 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -62.06 -46.66 88.15 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 122.973 0.509 . . . . 72.33 109.92 167.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -82.84 -24.33 33.35 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.349 0.5 . . . . 75.23 112.349 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.628 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.0 m-85 -81.18 -12.3 59.22 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.543 0.737 . . . . 75.32 111.239 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.628 ' HA ' ' SD ' ' A' ' 21' ' ' MET . 96.9 p -55.78 -28.71 57.49 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.669 0.606 . . . . 60.11 110.568 176.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.74 104.82 13.26 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.406 -1.331 . . . . 72.21 107.406 162.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -69.67 -23.73 63.5 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.728 0.811 . . . . 74.32 110.3 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -63.34 -35.87 81.81 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.16 -0.927 . . . . 74.5 111.884 174.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -58.55 -46.37 87.0 Favored 'General case' 0 C--O 1.256 1.44 0 C-N-CA 124.262 1.025 . . . . 75.53 109.795 175.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.632 HG23 ' SG ' ' A' ' 24' ' ' CYS . 30.7 mt -56.12 -57.43 8.56 Favored 'Isoleucine or valine' 0 C--N 1.356 0.877 0 CA-C-N 115.229 -0.896 . . . . 73.11 109.766 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.2 t -56.53 -34.9 67.48 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.358 1.036 . . . . 62.12 111.504 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -66.06 -45.37 81.57 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.529 0.732 . . . . 75.14 111.702 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.39 -22.81 32.64 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 121.122 -0.231 . . . . 74.41 110.418 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 tp -79.19 -29.44 42.9 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.934 0.894 . . . . 73.53 111.259 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -72.1 -17.2 62.0 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.84 -0.618 . . . . 75.34 110.873 176.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -121.49 16.43 11.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.66 1.184 . . . . 63.12 111.002 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.7 p -78.39 130.01 35.62 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 109.55 -0.537 . . . . 72.31 109.55 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -80.35 -11.04 59.75 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.284 0.634 . . . . 74.15 110.586 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -124.8 164.11 20.69 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.587 1.155 . . . . 74.33 110.019 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.11 -33.07 16.41 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.77 0.828 . . . . 72.12 110.18 176.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp -80.88 122.73 36.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 C-N-CA 123.07 0.548 . . . . 72.05 109.561 -173.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.671 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 5.8 tp -68.14 -41.99 80.78 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.034 0.933 . . . . 74.54 110.849 -175.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.43 ' CD1' ' HB3' ' A' ' 97' ' ' LEU . 69.8 m-85 -106.49 36.86 2.47 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 114.046 -1.434 . . . . 75.25 109.889 -175.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.61 -58.52 5.63 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.78 0.832 . . . . 74.52 112.781 -175.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.7 -49.84 69.29 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.393 -0.821 . . . . 74.42 111.219 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.79 -43.69 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 123.4 0.68 . . . . 75.24 111.006 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.47 HD22 ' NH1' ' A' ' 34' ' ' ARG . 33.0 t30 -71.16 -28.05 63.98 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.193 0.997 . . . . 72.34 110.516 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.39 -35.03 79.72 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.845 -0.798 . . . . 74.13 108.845 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -64.55 -53.48 47.17 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 109.796 -0.446 . . . . 73.32 109.796 168.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.496 HD12 ' HB2' ' A' ' 68' ' ' ALA . 10.7 mp -52.07 -38.45 57.19 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.034 0.534 . . . . 74.45 111.348 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.0 t -74.48 -56.62 4.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.326 0.65 . . . . 71.22 110.471 -175.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -53.9 -55.21 28.98 Favored 'General case' 0 C--O 1.257 1.466 0 C-N-CA 124.547 1.139 . . . . 71.44 110.715 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.2 t -65.62 -50.26 72.69 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 CA-C-N 113.547 -1.661 . . . . 70.21 110.84 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.54 -37.39 85.93 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 118.687 0.676 . . . . 73.52 111.478 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -56.69 -60.3 3.76 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.541 0.525 . . . . 72.43 109.764 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.45 -42.29 70.43 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 124.028 0.83 . . . . 73.32 111.315 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.01 -58.48 4.85 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.192 1.397 . . . . 74.35 110.156 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.2 p -59.09 -41.16 87.41 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.594 0.757 . . . . 73.13 111.602 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.19 -46.29 84.57 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.094 0.557 . . . . 72.14 112.286 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.8 HD13 HD12 ' A' ' 58' ' ' LEU . 4.2 pp -72.4 -22.94 61.05 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 122.271 -0.268 . . . . 64.15 110.706 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.551 HD11 ' SD ' ' A' ' 122' ' ' MET . 88.1 mt -72.79 -36.01 67.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.402 0.681 . . . . 71.43 110.616 171.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -38.72 86.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 75.45 109.756 171.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 97.2 t -68.99 -60.49 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.085 0 C-N-CA 123.53 0.732 . . . . 61.34 111.558 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.16 -60.93 2.16 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.622 0.769 . . . . 70.34 111.358 -172.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -93.63 -2.63 53.81 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 114.935 -1.03 . . . . 62.53 111.2 -166.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.34 15.78 7.96 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.307 1.043 . . . . 73.21 110.72 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.552 ' HG2' HG21 ' A' ' 124' ' ' VAL . 40.2 ttm -66.61 116.84 38.59 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 123.814 0.846 . . . . 63.21 110.334 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -82.7 13.92 2.46 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 123.315 2.677 . . . . 65.52 113.231 -168.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.552 HG21 ' HG2' ' A' ' 122' ' ' MET . 45.2 t -74.24 108.69 5.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 C-N-CA 123.284 0.634 . . . . 73.43 110.13 -177.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.1 t -156.0 68.85 4.98 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 115.75 -0.659 . . . . 65.35 109.446 175.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.38 -24.32 10.81 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.234 1.956 . . . . 73.51 111.02 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 12.0 tt -80.88 -31.51 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 124.856 1.262 . . . . 75.54 110.33 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.2 m 60.04 -77.68 0.02 OUTLIER 'General case' 0 C--N 1.361 1.079 0 C-N-CA 125.361 1.464 . . . . 73.13 111.256 -172.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -48.13 2.94 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.675 0.79 . . . . 71.2 109.017 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.5 11.01 6.26 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 115.798 -0.637 . . . . 72.12 112.314 -167.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.51 98.69 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 123.748 0.819 . . . . 72.15 110.886 176.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 33.1 p -60.94 -46.3 91.26 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.111 -0.95 . . . . 70.22 110.378 174.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 12.2 m0 -62.18 -23.74 66.78 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.209 1.003 . . . . 73.44 113.006 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.0 -48.95 41.04 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-O 120.821 0.343 . . . . 74.2 110.828 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -70.05 -35.85 74.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.471 -0.786 . . . . 75.2 112.019 -178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -60.67 -49.14 78.7 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.409 0.683 . . . . 74.55 111.191 -177.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -73.93 -39.78 63.57 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.731 -0.668 . . . . 72.33 112.011 -175.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -58.28 -59.0 6.0 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.618 -0.512 . . . . 75.3 109.618 176.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -52.7 -61.75 2.09 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 124.603 1.189 . . . . 54.14 111.095 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.653 ' HA ' ' HZ1' ' A' ' 26' ' ' LYS . 1.1 m-20 -64.98 -50.74 65.16 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.077 -0.965 . . . . 74.45 111.489 -168.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.4 ' HA ' ' NE2' ' A' ' 27' ' ' GLN . . . -73.17 -28.9 62.48 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.813 0.696 . . . . 62.51 112.507 -172.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.18 -47.09 68.88 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.784 -0.45 . . . . 71.43 109.784 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.43 -37.06 85.83 Favored 'General case' 0 N--CA 1.484 1.25 0 O-C-N 123.915 0.759 . . . . 75.42 111.828 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.579 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 25.4 t0 -78.36 -42.92 29.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.94 0.896 . . . . 72.11 110.923 -171.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -63.6 -40.62 97.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 108.338 -0.986 . . . . 73.04 108.338 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -60.0 -46.89 88.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.043 0.937 . . . . 74.41 110.859 175.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.38 -23.22 60.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.343 0.657 . . . . 74.21 111.632 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.42 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.8 OUTLIER -73.04 -57.13 4.25 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.171 0.588 . . . . 65.33 109.462 178.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -74.33 -47.29 35.48 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.341 -0.845 . . . . 74.03 110.599 -173.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 38.5 ttm -89.35 73.46 7.96 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 107.151 -1.425 . . . . 74.42 107.151 168.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 17.5 tp -84.0 66.31 9.13 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.069 -0.969 . . . . 72.34 109.8 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -102.19 -31.78 10.41 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.487 0.715 . . . . 75.13 110.476 -175.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -62.03 -65.67 0.65 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.366 0.666 . . . . 73.52 110.263 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -131.68 108.25 9.36 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 115.994 -0.548 . . . . 71.44 110.483 -169.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -139.02 76.05 1.55 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.46 1.104 . . . . 73.11 108.252 175.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 . . . . . 0 CA--C 1.558 1.268 0 C-N-CA 124.963 1.305 . . . . 75.43 111.089 -177.076 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptm . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.419 -0.324 . . . . 74.23 111.293 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 52.24 -75.67 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 126.762 2.025 . . . . 72.12 112.167 173.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -48.58 -45.17 37.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.027 1.331 . . . . 75.13 109.997 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.9 mt -57.37 -43.25 83.41 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.747 -1.115 . . . . 73.24 111.949 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -59.13 -46.68 87.73 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.565 0.541 . . . . 72.54 110.16 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -62.6 -43.55 98.53 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.927 -0.578 . . . . 64.21 111.618 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.78 -48.77 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 124.3 1.04 . . . . 73.41 110.96 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.7 mt -62.68 -42.25 95.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 CA-C-N 114.602 -1.181 . . . . 75.44 111.151 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.412 ' O ' HG22 ' A' ' 13' ' ' VAL . 96.5 m -61.02 -50.56 72.87 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.368 0.667 . . . . 73.3 110.252 178.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.2 -42.23 94.64 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.6 0.76 . . . . 73.41 111.019 -177.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.12 99.7 Favored Glycine 0 C--N 1.349 1.254 0 O-C-N 123.618 0.574 . . . . 61.23 112.887 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.35 -43.03 92.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 122.268 0.227 . . . . 71.34 111.242 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 9' ' ' THR . 86.2 t -61.71 -35.32 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.637 0.775 . . . . 75.21 110.526 177.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -59.88 -61.02 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.326 1.05 . . . . 75.25 110.439 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.9 -33.12 73.65 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 123.644 0.59 . . . . 74.41 111.187 -175.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -62.21 -60.73 3.16 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.267 1.027 . . . . 73.32 110.825 177.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -78.57 -17.18 56.51 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.134 0.573 . . . . 73.44 112.514 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.5 t -60.95 -16.75 46.25 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.22 1.008 . . . . 61.52 111.49 175.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -58.39 -16.27 14.05 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.61 0.764 . . . . 71.54 112.685 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -62.3 -30.73 71.35 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.613 0.765 . . . . 74.25 111.818 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.5 mmt -67.85 90.38 0.29 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 120.909 0.385 . . . . 73.22 110.264 -175.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.75 -49.43 53.13 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 107.806 -1.183 . . . . 74.31 107.806 173.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -93.63 -179.51 5.04 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.53 -1.668 . . . . 73.13 109.721 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.598 ' SG ' HG22 ' A' ' 85' ' ' ILE . 34.1 m 53.01 56.24 7.83 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-O 122.199 1.0 . . . . 74.22 110.008 -167.502 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.87 -49.83 41.83 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 113.109 -1.86 . . . . 73.15 110.624 -169.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.1 -39.77 63.16 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.807 -1.088 . . . . 73.53 108.975 -174.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -65.12 -27.01 68.44 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.31 0.644 . . . . 63.35 112.031 173.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.3 t -77.24 -35.33 55.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 122.605 0.362 . . . . 75.05 110.656 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -70.07 -33.4 71.86 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 116.412 -0.358 . . . . 71.3 110.416 172.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.465 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -67.94 -58.18 4.97 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.62 0.768 . . . . 74.44 109.822 179.699 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.97 -44.91 83.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.417 1.087 . . . . 73.4 110.359 178.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.58 -49.61 72.19 Favored Glycine 0 C--N 1.346 1.139 0 O-C-N 124.064 0.852 . . . . 74.42 112.87 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -65.9 -38.01 87.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.874 0.47 . . . . 73.15 111.399 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 83.3 mtt-85 -60.0 -53.59 56.08 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.059 0.543 . . . . 73.51 110.672 178.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 39' ' ' ILE . 61.9 t -59.5 -50.49 79.72 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.425 0 O-C-N 124.25 0.968 . . . . 65.3 110.846 -177.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.52 -46.49 85.79 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.6 0.563 . . . . 74.33 111.426 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.52 -19.15 74.36 Favored Glycine 0 N--CA 1.468 0.828 0 O-C-N 123.303 0.377 . . . . 74.43 113.367 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -86.64 -48.16 8.55 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.658 0.783 . . . . 73.11 111.663 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 35' ' ' VAL . 14.0 pt -79.54 -34.73 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 119.366 -0.35 . . . . 72.31 111.373 -173.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -57.33 -51.84 78.67 Favored Pre-proline 0 N--CA 1.488 1.449 0 N-CA-C 113.843 1.053 . . . . 73.53 113.843 -174.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.474 ' HB2' HG11 ' A' ' 124' ' ' VAL . 30.2 Cg_endo -60.32 -31.78 93.28 Favored 'Trans proline' 0 C--N 1.386 2.542 0 C-N-CA 121.573 1.515 . . . . 53.23 112.042 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.69 -40.99 72.58 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.169 0.588 . . . . 73.33 110.52 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.64 -37.36 83.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.568 0.747 . . . . 74.44 111.016 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 33.2 mmt -59.0 -55.05 40.21 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.909 0.756 . . . . 74.32 111.173 -178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 pp -77.42 -33.68 54.88 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.519 -0.764 . . . . 55.52 112.355 -175.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.81 -43.54 62.58 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.311 0.644 . . . . 74.12 110.066 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.12 -41.39 94.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.994 0.518 . . . . 75.44 110.377 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -63.95 -38.23 90.34 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.099 -0.955 . . . . 73.52 110.913 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -166.49 113.25 0.54 Allowed Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.846 -0.902 . . . . 71.14 110.846 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -77.24 4.51 10.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.274 0.63 . . . . 74.13 111.054 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.6 mmm180 -64.04 118.65 8.8 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.759 0.824 . . . . 74.51 110.872 -177.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 15.1 m -146.83 144.63 29.46 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 124.127 0.971 . . . . 63.31 108.404 177.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 52.4 t -90.4 104.31 8.64 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 107.448 -1.316 . . . . 73.4 107.448 166.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.525 ' HA ' HD12 ' A' ' 58' ' ' LEU . 5.4 Cg_exo -79.25 86.85 1.62 Allowed 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 122.204 1.936 . . . . 53.51 110.471 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.6 p -76.59 177.22 7.65 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 115.648 -0.706 . . . . 73.45 109.302 171.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -58.95 -58.67 7.64 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.195 0.598 . . . . 72.43 111.044 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.9 -18.61 60.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.345 0.498 . . . . 72.22 112.345 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 54' ' ' PRO . 3.5 tm? -65.9 -56.19 13.08 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 108.085 -1.079 . . . . 73.53 108.085 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 m -62.21 -39.73 93.74 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.071 -0.968 . . . . 72.3 110.824 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 88.5 m -61.44 -44.81 96.47 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.542 0.737 . . . . 74.11 111.36 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.85 86.08 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.142 0.577 . . . . 63.14 110.772 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.83 -27.82 68.53 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.746 0.654 . . . . 62.45 111.037 176.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -75.0 -41.27 59.8 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.144 0.577 . . . . 63.32 110.463 176.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 60' ' ' THR . 87.8 mtt180 -62.2 -40.55 96.44 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.31 0.576 . . . . 74.02 110.161 174.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.404 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.6 OUTLIER -65.88 -56.75 10.21 Favored 'General case' 0 C--O 1.216 -0.666 0 CA-C-N 114.422 -1.263 . . . . 75.33 109.277 -177.45 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.401 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.0 tmtt? -55.04 -41.28 71.21 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.876 1.27 . . . . 75.2 110.713 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.08 97.78 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.357 0.663 . . . . 63.14 111.296 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.469 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -67.4 -39.48 85.57 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.614 0.766 . . . . 75.23 111.156 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.404 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.4 mm? -67.02 -32.31 73.45 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.539 0.736 . . . . 74.31 111.002 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.8 mt-10 -68.08 -40.64 82.64 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.138 0.575 . . . . 74.1 111.288 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.9 mt-10 -67.92 -38.75 83.3 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.167 0.587 . . . . 72.22 110.11 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.45 ' HA ' ' HE2' ' A' ' 98' ' ' PHE . . . -64.71 -45.85 84.82 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.113 0.565 . . . . 71.35 110.603 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -59.51 -38.97 82.33 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 124.675 1.19 . . . . 74.1 110.561 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.3 -40.36 80.89 Favored Glycine 0 C--N 1.344 0.996 0 CA-C-N 114.894 -1.048 . . . . 75.52 112.472 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 24.0 mm-40 -68.07 -45.23 74.41 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.976 -0.535 . . . . 74.34 111.208 -178.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.497 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.7 OUTLIER -68.02 -26.39 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 CA-C-N 118.525 0.602 . . . . 73.02 111.544 175.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.76 -35.06 79.87 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.031 0.443 . . . . 65.43 110.315 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -76.43 -38.39 55.58 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.264 0.626 . . . . 74.13 110.847 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -75.01 -7.41 53.57 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.906 0.882 . . . . 65.43 112.596 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.4 p -57.72 -33.09 68.05 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.18 0.514 . . . . 71.22 110.308 176.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.05 109.81 5.35 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 107.721 -1.214 . . . . 73.33 107.721 164.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -67.57 -30.21 69.77 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 123.563 0.745 . . . . 74.44 111.022 -170.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -72.99 -27.17 61.64 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.153 -0.93 . . . . 75.13 111.67 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -60.85 -40.98 94.96 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 123.794 0.838 . . . . 72.03 110.866 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.598 HG22 ' SG ' ' A' ' 24' ' ' CYS . 16.0 mt -61.06 -55.3 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.165 -0.925 . . . . 74.12 109.252 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.1 -31.07 68.59 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.455 0.702 . . . . 72.55 111.607 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -63.17 -47.62 81.87 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.335 1.054 . . . . 64.04 111.321 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -29.84 43.1 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 120.243 -0.583 . . . . 72.02 110.285 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.425 ' HA ' ' HB3' ' A' ' 92' ' ' SER . 6.8 tp -74.49 -27.0 60.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.682 0.793 . . . . 64.23 111.512 -169.457 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -71.88 -22.1 61.56 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.947 0.499 . . . . 72.42 110.842 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.44 -35.72 13.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.901 0.88 . . . . 72.44 110.145 174.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.425 ' HB3' ' HA ' ' A' ' 89' ' ' LEU . 32.1 t -71.61 131.74 43.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.116 0.967 . . . . 72.44 110.974 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -96.45 -47.33 6.01 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.707 0.803 . . . . 74.11 110.318 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -149.46 13.68 0.85 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 75.45 110.317 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -70.54 101.02 1.91 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 106.854 -1.536 . . . . 72.35 106.854 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 12.4 mm -58.22 150.99 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.324 1.049 . . . . 73.34 110.103 -169.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.432 HD13 ' SG ' ' A' ' 24' ' ' CYS . 5.4 tp -49.47 -40.58 37.6 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.389 0.676 . . . . 74.51 111.529 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.531 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 36.1 m-85 -124.38 42.42 3.26 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.681 -1.145 . . . . 74.34 109.993 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -49.87 -66.1 0.45 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.556 0.743 . . . . 75.35 110.461 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.18 -46.78 72.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.088 0.868 . . . . 65.12 111.293 -175.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.8 t -67.58 -55.97 15.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.582 -0.736 . . . . 73.43 111.315 -172.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.531 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 13.8 t30 -63.38 -28.41 69.97 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.999 0.92 . . . . 74.1 111.012 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -61.57 -42.85 99.45 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 110.146 -0.316 . . . . 72.22 110.146 170.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -59.45 -48.44 81.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 123.351 0.407 . . . . 74.11 110.764 173.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.469 HD11 ' HB1' ' A' ' 68' ' ' ALA . 10.0 mp -55.52 -41.63 73.39 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.537 0.335 . . . . 74.1 110.465 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.1 t -64.83 -52.92 54.13 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.151 0.98 . . . . 73.23 111.012 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.513 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.7 m-20 -65.76 -46.55 78.4 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.672 0.789 . . . . 75.23 111.787 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 85.2 t -66.99 -35.9 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 122.714 0.406 . . . . 74.51 110.545 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.507 ' HH2' HG12 ' A' ' 124' ' ' VAL . 21.4 t-105 -62.74 -41.57 99.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.706 0.402 . . . . 71.53 110.8 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.513 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtpt -56.33 -56.16 24.5 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 123.465 0.478 . . . . 75.25 109.746 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.55 -38.97 72.62 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.217 1.007 . . . . 62.41 111.331 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.0 OUTLIER -66.14 -59.62 3.59 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.237 0.961 . . . . 73.02 109.072 -173.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -59.06 -33.2 70.5 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.07 0.948 . . . . 72.34 111.195 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.443 ' O ' HG21 ' A' ' 118' ' ' VAL . 70.8 mt -60.55 -63.85 1.16 Allowed 'General case' 0 C--N 1.358 0.946 0 O-C-N 123.752 0.657 . . . . 64.34 111.193 173.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.02 -29.86 71.15 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.34 0.496 . . . . 75.31 112.34 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.537 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 88.4 mt -66.78 -45.42 78.5 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.854 0.862 . . . . 74.44 110.603 175.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -76.97 -20.29 56.27 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.079 0.152 . . . . 62.42 111.365 -179.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.443 HG21 ' O ' ' A' ' 114' ' ' LEU . 54.7 t -71.72 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 123.342 0.657 . . . . 71.54 110.749 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -89.96 -58.48 2.49 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.324 0.583 . . . . 74.42 111.781 -175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -77.8 -12.86 60.01 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.137 -0.938 . . . . 75.15 110.855 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.451 ' O ' ' HD3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER 64.17 18.13 11.08 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.341 1.457 . . . . 72.53 110.787 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.537 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 87.9 mtp -64.12 112.66 8.02 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.498 0.719 . . . . 74.21 110.038 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -87.03 41.22 0.73 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 123.821 3.014 . . . . 72.12 110.753 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.507 HG12 ' HH2' ' A' ' 109' ' ' TRP . 20.1 t -88.11 87.78 2.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 114.629 -1.169 . . . . 72.03 108.76 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.9 t -164.07 69.44 1.62 Allowed Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 114.307 -1.315 . . . . 73.03 108.177 171.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -76.8 3.84 6.18 Favored 'Trans proline' 0 C--N 1.387 2.559 0 C-N-CA 122.884 2.39 . . . . 73.14 112.334 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 20.4 tt -116.24 -10.11 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 124.668 1.187 . . . . 74.14 110.231 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.9 t 64.83 -152.34 0.28 Allowed 'General case' 0 C--N 1.36 1.063 0 C-N-CA 124.596 1.158 . . . . 72.42 109.328 -174.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.476 HE21 ' HB3' ' A' ' 131' ' ' ALA . 12.9 pt20 -58.51 -29.58 66.39 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.415 0.686 . . . . 73.04 111.907 174.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' A' ' 133' ' ' TRP . . . 73.53 53.95 7.08 Favored Glycine 0 C--N 1.353 1.476 0 O-C-N 123.624 0.578 . . . . 73.32 112.211 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.476 ' HB3' HE21 ' A' ' 129' ' ' GLN . . . -64.12 -26.8 68.7 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.433 0.693 . . . . 74.52 111.333 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 63.2 p -63.1 -37.87 88.92 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.099 -0.955 . . . . 72.25 111.193 174.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.456 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 0.6 OUTLIER -50.2 -45.66 53.87 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.593 1.157 . . . . 72.3 113.091 -174.828 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.78 -36.03 79.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.009 0.523 . . . . 73.4 111.577 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -74.75 -36.27 62.59 Favored 'General case' 0 C--O 1.257 1.452 0 C-N-CA 123.301 0.64 . . . . 64.42 110.313 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 37.7 mt-10 -58.16 -62.5 1.78 Allowed 'General case' 0 C--N 1.355 0.818 0 CA-C-N 114.338 -1.301 . . . . 75.41 109.184 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -52.57 -37.06 57.16 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.041 0.838 . . . . 74.12 112.748 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -63.4 -60.63 3.12 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.267 0.354 . . . . 74.24 110.571 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -36.33 83.75 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.456 1.122 . . . . 73.43 110.0 -176.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.67 -63.63 1.02 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 113.493 -1.685 . . . . 73.02 110.32 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -63.83 -25.23 68.08 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 124.372 1.045 . . . . 60.32 111.564 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 17.4 t70 -60.42 -63.5 1.28 Allowed 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.526 -0.546 . . . . 72.23 109.526 175.318 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.8 -32.0 73.48 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 123.694 0.621 . . . . 63.41 112.116 -177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -71.65 -35.79 70.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.083 0.553 . . . . 74.03 110.644 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -67.0 -39.78 87.19 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.929 0.892 . . . . 75.35 109.216 174.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 12.2 mmt180 -61.34 -48.77 79.81 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.508 0.505 . . . . 75.41 110.0 177.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.32 69.82 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.436 0.695 . . . . 63.31 111.993 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.86 -58.89 3.07 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.569 0.543 . . . . 74.22 110.275 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -75.2 -53.13 9.34 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.324 0.65 . . . . 63.22 111.313 -170.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.8 ttm -86.14 71.22 10.58 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.057 -1.46 . . . . 64.32 107.057 167.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.6 tp -74.75 107.86 7.12 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.196 -0.911 . . . . 73.04 108.901 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.31 -56.83 0.25 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 106.709 -1.589 . . . . 74.13 106.709 -173.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -89.55 85.21 6.44 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.006 -0.997 . . . . 74.33 108.545 176.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 30.3 t70 170.99 -65.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.369 1.867 . . . . 73.33 106.97 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -155.79 164.01 39.1 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.661 -1.154 . . . . 73.01 108.203 175.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 . . . . . 0 CA--C 1.554 1.114 0 C-N-CA 123.437 0.695 . . . . 75.11 109.448 177.441 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.406 ' HE2' ' HB3' ' A' ' 1' ' ' MET . 38.5 ttp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 120.247 0.07 . . . . 75.4 110.996 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -61.39 -30.66 70.69 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.64 1.176 . . . . 74.22 111.317 -175.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -60.86 -53.86 52.2 Favored 'General case' 0 N--CA 1.482 1.142 0 O-C-N 123.759 0.662 . . . . 75.53 109.51 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.417 ' O ' HG12 ' A' ' 8' ' ' ILE . 52.8 mt -65.84 -36.53 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.587 -1.188 . . . . 74.03 111.29 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -58.95 -48.17 82.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.542 -0.91 . . . . 75.34 108.542 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -70.21 -42.29 72.51 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-N 115.923 -0.58 . . . . 72.01 111.961 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.4 mt -56.62 -46.26 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.265 0.555 . . . . 74.52 110.892 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 4' ' ' LEU . 35.3 mm -72.72 -42.32 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.397 -0.819 . . . . 73.34 111.023 -176.114 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -64.34 -53.99 39.96 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.351 0.261 . . . . 73.11 110.453 178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.9 mt -57.02 -51.5 69.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.925 0.89 . . . . 73.13 111.263 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.426 ' HA3' HG23 ' A' ' 39' ' ' ILE . . . -64.59 -32.04 82.88 Favored Glycine 0 C--N 1.344 1.021 0 O-C-N 123.907 0.755 . . . . 51.24 113.714 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.5 -44.99 56.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 122.689 -0.301 . . . . 74.34 110.632 176.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.443 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 75.3 t -59.31 -35.89 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.309 0.643 . . . . 75.22 109.893 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.545 HG23 HG23 ' A' ' 35' ' ' VAL . 29.6 mt -57.5 -54.36 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.464 1.105 . . . . 75.44 109.882 171.726 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -53.85 -34.93 60.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.941 0.896 . . . . 64.34 111.463 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -77.45 -47.22 20.27 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 112.266 0.469 . . . . 73.11 112.266 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.3 ptp180 -83.76 -17.24 41.83 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 112.851 0.686 . . . . 74.15 112.851 -173.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.08 -24.87 67.58 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.035 0.534 . . . . 61.13 111.671 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.8 -7.16 49.36 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.146 0.424 . . . . 74.54 112.146 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -61.14 -21.6 63.9 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.485 0.714 . . . . 74.01 111.612 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.433 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 21.6 mmt -67.78 88.57 0.25 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 124.013 0.821 . . . . 74.54 109.891 176.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.468 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 0.2 OUTLIER -69.93 -30.73 68.19 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.462 0.649 . . . . 75.01 109.901 170.343 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.433 ' O ' ' HB3' ' A' ' 21' ' ' MET . 53.0 m-85 -106.44 172.87 6.58 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.256 1.022 . . . . 75.33 108.472 167.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 66.4 m 58.95 73.91 0.46 Allowed 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.456 0.646 . . . . 75.34 110.705 -170.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.99 -59.49 2.88 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.715 1.206 . . . . 73.3 110.665 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.605 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 45.8 mmtm -68.33 -29.07 67.73 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 114.439 -1.255 . . . . 74.41 110.323 -175.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.419 ' HG2' ' CB ' ' A' ' 97' ' ' LEU . 0.3 OUTLIER -71.88 -40.18 69.11 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 123.611 0.569 . . . . 74.22 111.562 177.275 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.53 -41.32 97.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.315 0.578 . . . . 75.35 109.831 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -77.27 -24.14 51.08 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.093 -0.958 . . . . 75.11 111.487 176.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' ' 137' ' ' ASP . 0.1 OUTLIER -70.13 -57.82 4.51 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 122.077 0.941 . . . . 74.12 109.803 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.94 -44.97 91.21 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.115 -1.857 . . . . 75.11 108.86 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.58 -53.2 48.0 Favored Glycine 0 C--N 1.353 1.477 0 O-C-N 123.877 0.736 . . . . 70.15 113.625 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -63.29 -45.44 91.43 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.219 0.607 . . . . 73.44 111.342 -175.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.589 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.6 mtt-85 -58.35 -58.03 10.31 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 123.763 0.664 . . . . 73.13 110.913 178.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.545 HG23 HG23 ' A' ' 14' ' ' ILE . 79.2 t -56.94 -40.21 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.564 0.54 . . . . 75.52 111.358 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.7 mt -61.32 -48.39 81.56 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.589 0.356 . . . . 74.42 111.765 174.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.14 -21.44 61.68 Favored Glycine 0 N--CA 1.47 0.956 0 CA-C-N 116.613 -0.267 . . . . 74.23 113.202 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 61.7 mt -87.02 -52.19 5.58 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.383 0.673 . . . . 74.2 112.442 175.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.443 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 24.1 pt -74.23 -42.74 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 118.63 -0.7 . . . . 63.34 111.766 -169.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.442 ' O ' ' HG2' ' A' ' 44' ' ' MET . 53.2 mtmt -56.43 -51.49 80.59 Favored Pre-proline 0 N--CA 1.489 1.483 0 CA-C-O 118.071 -0.966 . . . . 70.51 112.786 -173.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 40' ' ' LYS . 77.8 Cg_exo -51.89 -45.64 37.25 Favored 'Trans proline' 0 C--N 1.4 3.249 0 C-N-CA 122.295 1.997 . . . . 75.02 112.334 174.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.45 HD13 HD22 ' A' ' 45' ' ' LEU . 4.5 mm? -66.39 -33.03 74.79 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.017 -0.992 . . . . 73.25 111.563 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 49.7 mt-10 -70.55 -35.17 72.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.403 0.681 . . . . 73.2 110.401 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.442 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -67.93 -47.13 69.57 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.477 0.485 . . . . 73.12 110.498 -178.275 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.45 HD22 HD13 ' A' ' 42' ' ' LEU . 4.2 pp -75.16 -30.87 60.87 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.744 0.418 . . . . 72.5 111.739 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -70.87 -35.43 72.37 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.325 0.65 . . . . 72.52 110.703 175.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.49 -55.2 22.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.177 0.591 . . . . 61.31 110.715 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -80.47 -19.31 46.28 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.532 -0.758 . . . . 65.54 111.826 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.6 170.25 24.1 Favored Glycine 0 C--N 1.349 1.29 0 C-N-CA 122.989 0.328 . . . . 61.2 112.721 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -165.72 -61.12 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.621 0.768 . . . . 74.43 110.226 -176.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -89.45 26.13 1.77 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.948 0.899 . . . . 75.42 110.792 -174.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 15.1 m -61.08 143.33 55.63 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 124.574 1.15 . . . . 73.4 110.342 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.4 t -108.14 102.35 45.81 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 123.526 0.73 . . . . 75.52 109.142 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -85.01 -158.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.353 2.702 . . . . 70.44 110.885 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 t -160.11 -177.44 6.29 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.182 0.593 . . . . 74.33 110.119 -175.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.8 -57.05 13.34 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.078 0.951 . . . . 72.55 111.55 -174.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -70.81 -23.64 62.4 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.816 0.446 . . . . 64.14 111.787 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -48.29 73.27 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.273 -1.01 . . . . 71.23 108.273 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 43.3 m -68.41 -41.73 80.0 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.947 -1.024 . . . . 74.54 111.066 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 62.4 m -61.27 -40.53 94.44 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.307 0.643 . . . . 64.21 110.704 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.458 ' HB3' HD22 ' A' ' 115' ' ' LEU . . . -64.4 -44.69 90.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.98 0.512 . . . . 74.23 110.454 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.486 ' SD ' HD12 ' A' ' 112' ' ' LEU . 22.9 mmt -64.0 -25.86 68.32 Favored 'General case' 0 CA--C 1.558 1.278 0 O-C-N 123.92 0.763 . . . . 75.02 111.844 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -77.14 -44.75 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.843 0.857 . . . . 73.31 110.772 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.5 mtp85 -61.12 -40.6 94.37 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.042 0.937 . . . . 75.12 109.393 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -67.92 -51.61 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 114.099 -1.409 . . . . 75.3 110.002 -177.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.407 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 14.5 tmtt? -54.97 -47.95 73.88 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.933 1.293 . . . . 75.34 110.999 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -65.25 -40.7 94.35 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.687 0.617 . . . . 60.14 111.407 -178.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.456 ' HB1' HD11 ' A' ' 105' ' ' LEU . . . -63.54 -41.57 98.44 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.21 0.604 . . . . 64.42 111.248 177.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.405 ' O ' HD13 ' A' ' 14' ' ' ILE . 11.0 mp -65.11 -32.17 73.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.335 0.654 . . . . 73.54 111.675 174.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 50.2 mt-10 -64.74 -40.91 96.12 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.685 0.394 . . . . 73.31 110.974 174.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 67' ' ' ALA . 47.8 mt-10 -62.54 -49.69 74.29 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.629 0.581 . . . . 74.31 110.031 177.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.458 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.22 -44.02 92.3 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 123.96 0.787 . . . . 63.03 111.103 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -59.92 -44.69 94.16 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.152 1.381 . . . . 74.14 110.77 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.67 -39.43 93.73 Favored Glycine 0 C--N 1.343 0.952 0 CA-C-N 114.996 -1.002 . . . . 74.42 112.32 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -59.97 -57.89 10.9 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.154 0.477 . . . . 54.45 110.302 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -63.55 -23.19 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 112.659 0.614 . . . . 75.24 112.659 177.453 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.413 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 33.4 tt0 -65.16 -44.64 87.9 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.584 0.354 . . . . 73.43 110.921 173.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -87.82 -19.11 27.91 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.513 0.325 . . . . 72.1 111.288 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 11.5 m-30 -82.0 0.84 38.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.43 0.692 . . . . 75.11 111.578 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 74.1 p -57.47 -24.9 58.46 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.316 0.646 . . . . 72.15 110.668 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -85.35 95.59 9.28 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 108.224 -1.028 . . . . 71.54 108.224 168.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.474 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -73.13 -31.63 64.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.715 0.806 . . . . 74.31 112.064 -169.434 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.8 p -74.11 -32.89 63.39 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.978 0.511 . . . . 72.33 110.803 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -66.43 -32.91 74.58 Favored 'General case' 0 C--O 1.249 1.06 0 C-N-CA 123.756 0.822 . . . . 70.5 109.964 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 36.9 mt -55.88 -53.05 42.38 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 109.017 -0.734 . . . . 74.42 109.017 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . 0.472 ' HB2' ' CE1' ' A' ' 148' ' ' PHE . 42.8 t -57.05 -39.35 74.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.909 0.884 . . . . 64.33 111.747 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -58.68 -51.24 70.78 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 114.994 -1.003 . . . . 72.05 110.891 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.41 -23.14 50.67 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.677 0.391 . . . . 72.13 110.831 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -72.21 -47.18 52.47 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.974 0.91 . . . . 74.43 110.506 -172.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -63.12 -29.04 70.48 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.838 -0.619 . . . . 75.12 110.415 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.41 61.03 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.59 0.756 . . . . 74.24 111.029 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 t -71.28 138.3 49.25 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.757 0.823 . . . . 73.31 109.899 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -90.12 -10.22 45.43 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.002 0.921 . . . . 70.52 110.821 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -106.1 149.15 27.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.501 0.667 . . . . 73.21 111.348 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.611 ' HD2' ' HA ' ' A' ' 142' ' ' ASP . 51.0 mtmt -86.84 -27.45 23.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.897 1.279 . . . . 74.42 110.536 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.458 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 2.5 mp -82.61 116.35 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 107.45 -1.315 . . . . 73.44 107.45 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.419 ' CB ' ' HG2' ' A' ' 27' ' ' GLN . 13.5 tp -69.57 -32.85 71.86 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.44 0.638 . . . . 63.22 111.157 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -109.21 16.76 22.22 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 115.033 -0.985 . . . . 74.2 111.669 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.458 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 85.6 tttt -42.54 -57.35 2.7 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.96 1.467 . . . . 75.01 114.96 -163.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.67 -48.7 65.89 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.906 0.882 . . . . 74.33 111.255 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 77.2 t -61.72 -52.72 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.948 0.899 . . . . 73.44 110.978 -179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -68.35 -26.32 65.53 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.873 1.269 . . . . 72.35 110.712 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.451 ' NH1' ' HB2' ' A' ' 107' ' ' ASP . 15.3 tpt180 -61.35 -43.59 98.61 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.446 0.699 . . . . 73.02 109.845 168.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -60.26 -49.77 76.29 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 119.046 -0.502 . . . . 71.34 111.577 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.456 HD11 ' HB1' ' A' ' 68' ' ' ALA . 8.8 mp -55.33 -37.84 67.96 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-N 118.607 0.639 . . . . 74.34 111.261 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.589 ' HB2' HH12 ' A' ' 34' ' ' ARG . 32.9 t -67.13 -53.03 34.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.804 0.842 . . . . 74.21 111.12 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.574 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 5.7 t70 -78.43 -29.23 46.95 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.745 -0.661 . . . . 74.21 111.146 -170.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.407 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 70.3 t -79.46 -27.38 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.947 0.499 . . . . 73.51 110.165 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.559 ' HH2' HG13 ' A' ' 124' ' ' VAL . 20.2 t-105 -65.45 -39.73 92.37 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 118.717 0.69 . . . . 73.51 110.21 168.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.574 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 49.2 mtpt -54.92 -59.05 5.27 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 123.494 0.496 . . . . 73.41 109.793 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 50.0 mt-10 -53.45 -47.96 69.26 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.523 1.14 . . . . 62.13 110.568 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.486 HD12 ' SD ' ' A' ' 62' ' ' MET . 2.6 tp -57.91 -59.66 4.9 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.382 1.073 . . . . 74.3 109.592 -173.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.3 t -55.08 -41.41 71.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.675 1.19 . . . . 75.43 112.103 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.41 -47.21 67.87 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.074 -0.512 . . . . 73.52 111.996 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 4.2 pp -78.4 -19.29 53.6 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.818 -0.551 . . . . 74.22 111.43 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.425 ' HG ' ' HE2' ' A' ' 122' ' ' MET . 2.0 mp -63.46 -53.36 53.31 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.923 -0.769 . . . . 65.11 108.923 169.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -72.18 -27.69 62.72 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.651 0.38 . . . . 73.05 112.024 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.93 -63.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.852 0.461 . . . . 75.22 110.956 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -85.36 -58.23 2.76 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.486 0.715 . . . . 74.53 111.484 -165.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -88.55 -2.97 58.89 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.284 0.634 . . . . 75.25 110.318 -176.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 54.85 35.85 25.21 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.73 1.612 . . . . 72.51 112.363 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.451 ' HB3' HG21 ' A' ' 124' ' ' VAL . 27.7 mtm -95.66 129.3 34.97 Favored Pre-proline 0 N--CA 1.477 0.917 0 O-C-N 121.669 -0.644 . . . . 70.54 110.336 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -89.41 30.87 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.523 2.815 . . . . 53.13 112.11 -175.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.559 HG13 ' HH2' ' A' ' 109' ' ' TRP . 46.6 t -72.4 91.45 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 123.91 0.884 . . . . 73.22 110.437 -172.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.0 t -163.22 70.41 1.9 Allowed Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.02 0.928 . . . . 75.44 109.018 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.88 -3.28 7.24 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.889 2.393 . . . . 75.01 112.365 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.0 tt -121.55 19.4 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.954 1.302 . . . . 72.23 109.44 -171.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.2 t 69.71 -177.63 0.21 Allowed 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 114.272 -1.331 . . . . 72.42 110.873 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -81.87 9.36 8.24 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.847 0.859 . . . . 71.2 110.685 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 94.96 29.74 8.87 Favored Glycine 0 C--N 1.342 0.873 0 N-CA-C 112.619 -0.192 . . . . 72.22 112.619 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -71.09 -42.39 69.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.893 0.477 . . . . 62.25 110.445 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 23.8 m -65.82 -30.31 70.92 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.602 -0.726 . . . . 74.41 111.13 172.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.427 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 22.0 m0 -68.93 -23.99 64.23 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.753 1.02 . . . . 73.52 113.753 -170.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.77 -25.26 48.94 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 120.796 0.331 . . . . 75.32 111.557 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -89.71 -50.83 5.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.738 0.815 . . . . 71.34 111.126 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.427 ' HG2' ' HA ' ' A' ' 133' ' ' TRP . 11.5 pt-20 -57.05 -42.33 80.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.528 0.731 . . . . 72.1 111.754 -174.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.415 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.0 OUTLIER -60.09 -51.26 70.36 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.152 0.581 . . . . 63.32 112.012 -177.355 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.42 -39.27 77.97 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.219 0.324 . . . . 64.45 111.515 -175.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -66.99 -57.91 5.97 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.642 0.734 . . . . 74.32 111.3 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.605 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 1.2 m-20 -55.53 -51.92 65.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.194 -1.366 . . . . 73.4 111.119 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -66.93 -27.26 67.34 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.286 0.476 . . . . 73.31 112.286 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.611 ' HA ' ' HD2' ' A' ' 95' ' ' LYS . 18.8 t70 -58.83 -58.45 8.58 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.102 -0.703 . . . . 74.03 109.102 172.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.58 -25.15 65.63 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.802 -1.544 . . . . 72.23 111.609 -177.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.453 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.2 t0 -84.51 -42.26 15.71 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.634 0.774 . . . . 75.43 111.898 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.417 ' HG2' ' HG2' ' A' ' 95' ' ' LYS . 9.9 tpt180 -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.751 0.82 . . . . 74.01 109.13 170.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -61.79 -43.96 97.82 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.409 -1.269 . . . . 74.11 110.773 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.1 -18.08 60.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.331 0.653 . . . . 72.44 112.325 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.472 ' CE1' ' HB2' ' A' ' 86' ' ' CYS . 0.5 OUTLIER -78.42 -60.81 2.22 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.967 -0.753 . . . . 73.22 108.967 176.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -73.73 -51.27 17.08 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.803 -1.09 . . . . 74.24 110.866 -171.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 28.4 mmt -101.82 51.74 0.83 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.065 -0.716 . . . . 73.13 109.065 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.8 tt -70.61 107.6 3.98 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.152 -0.931 . . . . 73.32 109.443 -176.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -128.08 96.73 4.55 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 107.395 -1.335 . . . . 73.12 107.395 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -153.37 -70.1 0.14 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.49 -0.323 . . . . 75.5 110.877 -173.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -127.25 -59.76 1.22 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.744 -1.206 . . . . 75.14 107.744 178.023 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 16.9 m120 58.89 27.53 16.32 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.316 1.046 . . . . 71.41 112.044 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 CA--C 1.564 1.485 0 C-N-CA 124.497 1.119 . . . . 75.35 110.891 -179.925 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.555 ' HE3' HD23 ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 119.751 -0.166 . . . . 72.31 111.332 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.15 -43.2 95.92 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.318 0.647 . . . . 63.35 111.247 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -67.76 -38.25 83.2 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.863 -0.608 . . . . 73.22 109.694 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 42' ' ' LEU . 31.6 tp -69.23 -36.52 77.28 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.134 -0.939 . . . . 72.21 110.734 176.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.444 ' HG2' ' OE1' ' A' ' 46' ' ' GLN . 3.2 tmtp? -63.6 -42.44 98.23 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 108.612 -0.885 . . . . 73.42 108.612 177.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -58.41 -44.74 89.14 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.291 0.994 . . . . 70.31 110.765 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 82.1 mt -54.31 -50.94 52.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 124.191 0.996 . . . . 74.14 111.077 174.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.5 HG12 ' O ' ' A' ' 4' ' ' LEU . 24.9 mm -63.27 -43.71 98.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.989 0.916 . . . . 75.42 111.02 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.8 m -64.15 -48.55 75.57 Favored 'General case' 0 C--N 1.348 0.511 0 O-C-N 123.966 0.791 . . . . 74.41 110.325 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.0 -45.87 86.15 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 124.025 0.828 . . . . 73.43 110.72 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.56 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -59.97 -46.05 94.82 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 124.346 1.029 . . . . 71.14 113.027 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -63.38 -49.63 73.07 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 122.56 0.344 . . . . 64.33 110.627 178.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.48 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 84.3 t -60.84 -33.15 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.759 0.824 . . . . 74.12 110.932 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.438 HG21 HG23 ' A' ' 35' ' ' VAL . 17.3 mt -57.82 -54.68 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.179 0.992 . . . . 72.54 109.007 174.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -62.2 -31.28 71.79 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.013 0.82 . . . . 72.01 111.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.86 -59.95 3.08 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.719 0.407 . . . . 73.53 111.172 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 16.4 ptp180 -73.34 -16.56 61.36 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 112.621 0.6 . . . . 70.34 112.621 -175.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 46.1 t -66.72 -22.83 66.05 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.305 0.642 . . . . 72.1 110.864 173.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -76.34 2.91 12.14 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 65.13 111.836 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -86.54 -1.22 57.45 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.536 0.734 . . . . 75.04 111.978 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 15.0 mmt -80.81 95.9 6.82 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.912 0.387 . . . . 74.44 110.987 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.619 ' HB3' ' HG2' ' A' ' 82' ' ' ARG . 12.1 tptt -67.97 -41.1 82.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.546 1.138 . . . . 65.13 110.014 170.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -97.17 -178.66 4.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 114.979 -1.01 . . . . 72.4 109.225 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.9 p 46.68 62.35 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.768 1.227 . . . . 74.23 111.608 175.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 22' ' ' LYS . 32.8 mmtp -73.39 -38.95 65.46 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.58 -1.191 . . . . 74.43 111.742 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.444 ' HG2' ' HA ' ' A' ' 140' ' ' ASP . 58.8 tptt -63.26 -47.67 81.42 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.832 -1.174 . . . . 74.11 107.832 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 -46.82 -54.37 10.01 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.848 1.659 . . . . 72.43 111.129 175.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.415 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 20.4 t -62.17 -50.78 70.47 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.725 1.21 . . . . 64.03 112.88 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -73.6 -37.75 65.33 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.207 0.603 . . . . 74.12 111.8 -171.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -81.15 -28.13 35.19 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.304 0.377 . . . . 74.41 110.066 -178.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.403 HD23 ' SG ' ' A' ' 18' ' ' CYS . 69.2 tp -62.26 -51.13 68.98 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 108.262 -1.014 . . . . 72.12 108.262 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.1 -36.2 91.98 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 124.152 0.908 . . . . 72.41 113.089 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -64.49 -53.92 40.61 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 124.031 0.933 . . . . 74.25 110.348 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -46.9 -60.69 2.27 Favored 'General case' 0 C--N 1.367 1.362 0 O-C-N 124.992 1.433 . . . . 71.13 109.282 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.438 HG23 HG21 ' A' ' 14' ' ' ILE . 48.2 t -57.64 -48.1 84.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 125.182 1.393 . . . . 74.54 112.596 -171.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.5 mt -65.48 -50.13 66.46 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 118.442 0.565 . . . . 74.04 110.726 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.12 -19.66 66.25 Favored Glycine 0 C--N 1.351 1.405 0 O-C-N 123.78 0.675 . . . . 74.25 112.752 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.547 HD13 ' HZ ' ' A' ' 65' ' ' PHE . 19.2 tp -84.46 -50.32 7.86 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.571 1.148 . . . . 73.43 111.974 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.56 HG21 ' HA3' ' A' ' 11' ' ' GLY . 10.1 pt -79.21 -30.95 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.1 0.56 . . . . 71.25 111.221 -171.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.521 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 15.4 tppt? -58.68 -53.98 60.85 Favored Pre-proline 0 CA--C 1.567 1.608 0 CA-C-O 118.031 -0.985 . . . . 74.24 113.033 -174.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -61.17 -31.09 89.8 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 121.613 1.542 . . . . 75.03 112.303 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.58 ' HB3' HD13 ' A' ' 4' ' ' LEU . 4.3 mm? -78.03 -36.55 48.45 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.448 0.699 . . . . 74.03 111.24 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.535 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 12.0 pt-20 -77.79 -20.34 53.47 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 119.192 -0.432 . . . . 72.55 111.574 -177.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.45 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.0 mmt -60.53 -56.31 22.87 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.45 0.469 . . . . 64.02 110.681 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 pp -72.64 -30.83 64.64 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.1 0.56 . . . . 75.21 111.437 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.535 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.0 OUTLIER -64.03 -44.61 92.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.507 0.723 . . . . 75.14 111.051 175.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.88 -37.2 85.96 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.864 0.866 . . . . 71.24 111.121 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -65.59 -24.66 67.13 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.908 -1.042 . . . . 73.52 110.892 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.69 29.01 60.12 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.536 0.522 . . . . 72.01 113.366 172.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -82.28 119.78 24.54 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.779 -0.452 . . . . 74.02 109.779 -177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -54.9 -41.88 71.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.924 0.89 . . . . 75.3 110.932 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.5 m 63.77 -160.44 0.3 Allowed 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.585 1.178 . . . . 73.15 109.809 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.52 87.24 5.07 Favored Pre-proline 0 CA--C 1.55 0.966 0 N-CA-C 108.208 -1.034 . . . . 75.4 108.208 165.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.528 ' HA ' ' HG ' ' A' ' 58' ' ' LEU . 97.4 Cg_endo -93.26 95.45 0.15 Allowed 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.907 2.404 . . . . 74.44 111.65 176.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.1 m -67.42 -177.52 0.73 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.859 0.864 . . . . 71.3 111.79 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -62.67 -37.91 88.26 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.822 0.449 . . . . 72.45 111.011 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -67.49 -31.6 71.85 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.334 0.654 . . . . 72.54 111.031 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.528 ' HG ' ' HA ' ' A' ' 54' ' ' PRO . 4.2 mm? -66.09 -50.74 63.02 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.105 0.562 . . . . 75.42 109.522 174.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 m -58.39 -48.68 79.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.174 0.99 . . . . 72.11 111.228 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -61.76 -43.97 97.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.057 0.943 . . . . 75.45 110.671 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.54 98.82 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.857 0.723 . . . . 73.25 110.928 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.455 ' HE2' HD11 ' A' ' 112' ' ' LEU . 31.2 mmt -64.38 -43.03 95.75 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.507 0.723 . . . . 74.42 110.694 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.6 -39.57 88.46 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 124.004 0.922 . . . . 75.32 111.3 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.413 ' NE ' HG22 ' A' ' 108' ' ' VAL . 49.7 ttt85 -72.34 -38.07 68.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.583 1.553 . . . . 75.31 111.002 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.547 ' HZ ' HD13 ' A' ' 38' ' ' LEU . 2.4 t80 -73.87 -43.77 57.52 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.896 -1.047 . . . . 70.12 109.515 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.0 ttpp -55.97 -47.42 77.69 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 114.288 -1.323 . . . . 75.42 109.925 172.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.87 92.2 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.826 0.85 . . . . 74.41 111.643 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.512 ' HB3' HD11 ' A' ' 105' ' ' LEU . . . -61.02 -42.3 98.2 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 115.421 -0.809 . . . . 74.43 110.978 175.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.02 -26.7 62.32 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.378 0.671 . . . . 73.11 111.852 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 97.8 mt-10 -65.58 -43.81 88.6 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 108.664 -0.865 . . . . 75.44 108.664 175.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.465 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 50.8 mt-10 -61.03 -52.69 63.92 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.741 -1.118 . . . . 74.43 110.365 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.468 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.91 -45.99 82.26 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 124.085 0.866 . . . . 74.05 111.454 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.08 -36.04 80.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.513 1.125 . . . . 71.5 110.28 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 77' ' ' GLU . . . -69.38 -36.02 77.22 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.289 -0.869 . . . . 74.12 112.881 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 14.4 mm-40 -65.33 -55.41 18.38 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.528 0.664 . . . . 74.22 110.041 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.468 HG12 ' O ' ' A' ' 72' ' ' ALA . 1.2 pt -64.2 -27.06 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 112.581 0.586 . . . . 75.53 112.581 176.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 74' ' ' GLY . 11.3 tt0 -56.39 -49.13 75.36 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.957 0.503 . . . . 72.54 110.669 169.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -78.03 -28.89 49.15 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.188 0.595 . . . . 74.25 110.968 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.441 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 19.2 m-30 -81.05 -5.8 58.05 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.767 0.827 . . . . 72.24 112.323 -178.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 97.1 p -60.14 -33.06 71.64 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.413 -0.588 . . . . 63.13 109.413 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -82.66 109.13 16.57 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.678 -1.23 . . . . 63.34 107.678 165.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.619 ' HG2' ' HB3' ' A' ' 22' ' ' LYS . 3.4 mpt_? -74.53 -25.65 59.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.25 0.62 . . . . 71.11 111.645 -172.121 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.3 m -62.84 -37.3 86.25 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.839 0.856 . . . . 71.14 110.592 174.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -60.35 -39.22 86.37 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 124.371 1.068 . . . . 75.2 111.072 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.409 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 26.0 mt -59.64 -53.96 41.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.201 0 O-C-N 123.829 0.706 . . . . 74.2 109.653 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 16.9 t -62.07 -38.05 87.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.13 0.572 . . . . 72.21 111.717 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.3 tpp180 -59.86 -47.88 83.97 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.389 1.076 . . . . 75.52 110.96 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.81 -22.39 40.07 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 116.15 -0.477 . . . . 75.01 110.555 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 17.3 tp -71.81 -41.24 68.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.776 0.831 . . . . 72.42 110.717 -173.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -71.22 -21.37 62.14 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.896 -0.593 . . . . 75.43 110.565 176.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.75 10.94 32.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.156 0.983 . . . . 70.31 111.058 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.4 t -70.92 124.38 24.2 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 123.14 0.576 . . . . 74.43 110.718 -174.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -83.34 -7.02 59.64 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.757 -1.111 . . . . 70.3 110.381 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -127.84 -172.51 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.151 0.981 . . . . 61.4 110.683 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.441 ' HG3' ' HB1' ' A' ' 141' ' ' ALA . 18.6 tptm -108.07 -39.67 5.44 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.772 0.829 . . . . 74.32 109.749 -176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.785 HG13 ' HB3' ' A' ' 141' ' ' ALA . 1.4 mp -87.64 153.17 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.15 -1.055 . . . . 70.25 108.15 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.93 -46.84 22.82 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.909 0.862 . . . . 74.01 108.792 174.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -98.51 34.6 1.98 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.152 -1.386 . . . . 73.52 110.455 -176.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.634 ' HG3' HD13 ' A' ' 96' ' ' ILE . 22.1 ttpt -52.58 -65.2 0.6 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.735 0.698 . . . . 75.24 112.058 -172.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -65.92 -47.85 73.39 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.82 0.7 . . . . 74.54 110.558 -173.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 84.4 t -60.7 -57.82 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 124.287 0.992 . . . . 72.0 111.951 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -72.32 -24.16 61.27 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.811 0.844 . . . . 75.15 111.273 -174.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -66.94 -35.9 81.03 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.95 -0.389 . . . . 74.5 109.95 168.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -69.67 -37.81 76.83 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 119.113 -0.47 . . . . 73.31 110.64 172.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.512 HD11 ' HB3' ' A' ' 68' ' ' ALA . 10.9 mp -55.61 -45.2 77.54 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.553 -0.536 . . . . 74.2 109.553 171.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -63.11 -53.86 46.9 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 124.127 0.892 . . . . 71.42 110.885 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -60.7 -52.92 63.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.549 1.14 . . . . 70.43 111.508 -174.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.413 HG22 ' NE ' ' A' ' 64' ' ' ARG . 59.1 t -63.02 -42.97 98.69 Favored 'Isoleucine or valine' 0 C--N 1.344 0.346 0 O-C-N 124.07 0.856 . . . . 73.12 110.345 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -61.76 -35.24 77.55 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.374 0.422 . . . . 73.33 111.403 177.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.408 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 57.6 mtpt -61.24 -55.35 32.99 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.712 -0.477 . . . . 74.14 109.712 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.1 -41.48 75.31 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.007 0.923 . . . . 74.01 111.05 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 3.7 tt -75.0 -47.78 27.42 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 114.115 -1.402 . . . . 72.04 110.45 -170.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.3 p -65.22 -33.41 75.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.222 0.609 . . . . 63.43 110.541 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.419 ' O ' HG23 ' A' ' 118' ' ' VAL . 80.0 mt -60.21 -57.13 14.12 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.892 0.745 . . . . 71.24 110.453 172.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.12 -23.77 67.23 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 111.801 0.297 . . . . 74.24 111.801 -178.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.7 mt -70.28 -45.58 66.06 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.876 -0.416 . . . . 72.34 109.876 171.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.418 ' O ' ' HA ' ' A' ' 121' ' ' ARG . 30.0 tt0 -77.13 -19.71 56.54 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.611 0.764 . . . . 71.45 111.185 -174.312 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 114' ' ' LEU . 64.1 t -91.36 -56.42 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 122.947 0.499 . . . . 74.34 110.288 177.17 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -73.51 -59.13 2.86 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.082 0.468 . . . . 71.44 110.736 -175.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -84.93 -16.43 41.1 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.588 -0.733 . . . . 72.33 110.767 -175.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 60.4 mtm-85 57.14 44.16 22.86 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.443 1.097 . . . . 74.22 110.013 -175.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.462 ' SD ' HD11 ' A' ' 116' ' ' LEU . 44.7 ttm -70.86 127.42 91.79 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 114.637 -1.165 . . . . 73.22 111.081 -174.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 6.3 Cg_exo -77.24 93.89 1.07 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.729 2.286 . . . . 73.41 109.846 170.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.84 113.25 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-O 121.327 0.584 . . . . 72.21 110.636 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.4 t -164.83 73.7 1.5 Allowed Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.141 0.976 . . . . 71.45 108.982 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -87.08 -3.21 7.98 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.838 2.358 . . . . 74.53 111.992 172.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 30.0 pt -97.16 153.37 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 C-N-CA 123.893 0.877 . . . . 75.43 109.239 -176.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 25.1 m -74.49 78.09 1.94 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.409 0.683 . . . . 54.44 110.233 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 72.0 -62.78 0.45 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.217 1.407 . . . . 72.54 112.963 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.03 -19.01 7.85 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 110.982 -0.847 . . . . 54.03 110.982 -167.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -74.75 -46.73 35.32 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.727 0.811 . . . . 75.15 110.585 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 59.5 p -71.96 -14.12 61.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.26 -0.882 . . . . 74.33 111.412 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -20.45 64.89 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.822 0.849 . . . . 74.32 112.292 175.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -84.0 -34.08 24.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.0 0.52 . . . . 61.5 111.492 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -80.0 -33.05 39.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.897 0.879 . . . . 74.22 111.584 -173.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -59.88 -37.54 79.65 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 123.492 0.495 . . . . 64.34 109.825 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.87 -37.71 83.06 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.628 1.171 . . . . 75.35 111.573 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -68.84 -50.31 51.1 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.265 0.353 . . . . 73.03 111.287 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.1 -42.02 93.78 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 123.806 0.691 . . . . 74.02 110.481 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.444 ' HA ' ' HG2' ' A' ' 26' ' ' LYS . 1.4 t70 -60.7 -54.1 49.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.052 1.741 . . . . 63.21 110.918 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.785 ' HB3' HG13 ' A' ' 96' ' ' ILE . . . -53.98 -53.02 58.61 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.13 -1.396 . . . . 74.2 112.067 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.57 -45.33 85.32 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.1 -1.409 . . . . 73.32 111.114 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.22 -52.47 58.63 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 124.728 1.268 . . . . 53.21 111.159 -172.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.51 -38.01 68.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 124.022 0.826 . . . . 73.11 111.725 -174.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.473 ' O ' ' HG2' ' A' ' 149' ' ' GLN . 0.0 OUTLIER -57.41 -50.23 73.68 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.498 0.499 . . . . 73.53 109.891 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.409 ' N ' ' HD3' ' A' ' 145' ' ' ARG . 5.7 tmm_? -71.47 -31.19 66.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.501 0.72 . . . . 71.3 110.035 -176.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.2 -19.83 53.09 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.189 0.596 . . . . 62.22 111.675 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -80.42 -50.94 9.43 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.772 -0.825 . . . . 75.15 108.772 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' ' 145' ' ' ARG . 25.1 mm-40 -60.82 -60.19 4.19 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.902 0.752 . . . . 63.21 109.581 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.467 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 5.9 mmt -99.8 66.67 1.41 Allowed 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.361 1.064 . . . . 65.13 109.071 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp -75.52 85.88 2.61 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-O 121.986 0.898 . . . . 71.44 109.864 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -109.7 -9.83 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.026 -0.988 . . . . 74.44 109.646 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -63.75 -28.48 69.91 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.23 1.012 . . . . 73.42 110.593 170.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -117.57 -66.49 1.07 Allowed 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.727 0.811 . . . . 74.21 109.951 170.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 7.0 t30 58.13 89.28 0.05 Allowed 'General case' 0 N--CA 1.48 1.053 0 O-C-N 124.332 1.02 . . . . 74.05 110.311 -173.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 . . . . . 0 CA--C 1.555 1.17 0 C-N-CA 123.676 0.791 . . . . 72.31 109.507 -173.61 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.423 ' HE3' ' HB2' ' A' ' 5' ' ' LYS . 14.8 ttp . . . . . 0 N--CA 1.483 1.201 0 N-CA-C 109.971 -0.381 . . . . 75.13 109.971 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -58.23 -50.48 73.43 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.139 0.976 . . . . 64.31 110.964 -177.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -68.88 -36.75 78.47 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 116.023 -0.535 . . . . 71.35 111.265 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.424 ' O ' HD11 ' A' ' 8' ' ' ILE . 4.1 mm? -62.97 -47.26 83.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.544 0.337 . . . . 74.45 110.519 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HA ' ' NE2' ' A' ' 46' ' ' GLN . 51.8 tptt -57.42 -43.27 83.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.309 0.644 . . . . 73.15 109.829 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -61.57 -63.98 1.09 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-O 118.385 -0.816 . . . . 72.32 111.085 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.0 mt -47.98 -45.59 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.094 0.958 . . . . 74.24 112.917 -174.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.463 ' HB ' ' NE2' ' A' ' 46' ' ' GLN . 1.7 mp -70.92 -48.55 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 115.647 -0.706 . . . . 64.55 110.987 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.1 m -61.62 -48.55 80.37 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 123.179 0.299 . . . . 74.34 110.305 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -57.19 -45.02 84.11 Favored 'General case' 0 C--O 1.208 -1.118 0 C-N-CA 124.648 1.179 . . . . 74.03 110.949 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.404 ' HA3' HG23 ' A' ' 39' ' ' ILE . . . -63.15 -42.29 99.49 Favored Glycine 0 C--N 1.347 1.167 0 O-C-N 124.244 0.965 . . . . 72.43 113.075 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -65.13 -43.24 92.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.198 0.599 . . . . 75.22 111.753 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -76.03 -25.29 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.619 0.767 . . . . 75.44 110.541 -178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.46 -51.77 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.841 0.856 . . . . 74.11 108.877 171.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -61.32 -36.54 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 124.12 0.888 . . . . 74.33 110.335 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -56.02 19.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.428 1.091 . . . . 74.21 110.56 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HD2' HG13 ' A' ' 76' ' ' ILE . 5.2 ptp180 -75.84 -16.28 60.1 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.679 -0.691 . . . . 72.13 111.723 -178.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.558 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 48.2 t -72.15 -21.53 61.44 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.29 0.636 . . . . 70.24 110.54 172.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -81.18 0.01 38.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.502 0.721 . . . . 74.45 111.979 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.5 -29.73 70.41 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.457 -0.572 . . . . 62.21 109.457 165.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.523 ' HE2' HG21 ' A' ' 76' ' ' ILE . 5.1 mmt -71.15 89.57 0.85 Allowed 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.066 -0.516 . . . . 73.22 109.623 -178.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -75.25 -27.21 59.37 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 108.496 -0.927 . . . . 72.32 108.496 170.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -93.33 172.32 8.36 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.597 1.159 . . . . 74.43 108.319 163.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.46 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 28.5 m 51.93 48.69 22.27 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.275 0.56 . . . . 53.25 110.878 -176.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.412 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 94.5 mttt -63.78 -41.04 98.02 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.047 -0.978 . . . . 72.43 111.035 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.533 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 0.5 OUTLIER -75.97 -22.92 55.4 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.958 -0.565 . . . . 74.4 109.735 -176.84 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.605 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 11.7 mm-40 -69.47 -40.56 77.02 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 123.005 0.522 . . . . 75.13 110.665 168.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.558 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 41.9 t -59.25 -42.63 91.55 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.359 0.663 . . . . 73.21 110.001 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.412 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 11.5 mpt_? -77.12 -30.31 55.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.429 -0.805 . . . . 74.44 111.859 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 ttp85 -71.39 -60.03 2.45 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.369 0.668 . . . . 70.23 110.453 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.444 HD21 ' SG ' ' A' ' 18' ' ' CYS . 46.9 tp -56.61 -43.8 80.51 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.714 -1.13 . . . . 74.21 109.978 174.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.09 -49.12 74.27 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.103 0.877 . . . . 73.43 113.192 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -60.95 -47.76 84.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.811 0.845 . . . . 73.43 110.903 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.455 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 31.5 mtt180 -60.59 -60.33 3.98 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.093 0.871 . . . . 72.21 111.286 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.91 -45.07 75.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 124.306 1.004 . . . . 73.21 111.528 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.49 -44.16 97.57 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.623 0.577 . . . . 74.51 110.752 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.09 -25.82 71.14 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 123.517 0.511 . . . . 62.13 113.521 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 40.8 mt -79.96 -49.8 11.34 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.385 0.674 . . . . 74.13 110.983 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.432 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 10.5 pt -74.43 -33.69 33.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 CA-C-O 118.372 -0.823 . . . . 73.52 111.224 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -44.53 -58.61 4.95 Favored Pre-proline 0 N--CA 1.503 2.2 0 C-N-CA 124.914 1.286 . . . . 71.2 113.87 -170.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.452 ' HG2' HD22 ' A' ' 42' ' ' LEU . 35.0 Cg_endo -62.72 -42.05 27.69 Favored 'Trans proline' 0 C--N 1.401 3.338 0 C-N-CA 121.383 1.389 . . . . 75.34 110.692 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HB3' HD13 ' A' ' 8' ' ' ILE . 3.6 mm? -70.11 -20.2 63.2 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.571 0.748 . . . . 74.35 111.499 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.44 ' HG2' HG22 ' A' ' 8' ' ' ILE . 63.7 mt-10 -73.62 -45.31 53.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.796 0.839 . . . . 74.53 109.561 175.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.459 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 26.4 mmt -62.4 -33.18 74.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.659 -0.7 . . . . 72.53 110.802 174.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.09 -21.06 36.97 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.007 0.923 . . . . 74.32 111.847 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.517 ' NE2' ' HA ' ' A' ' 5' ' ' LYS . 33.5 tt0 -75.27 -38.11 60.6 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.765 0.426 . . . . 61.11 110.042 173.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -64.4 -30.86 71.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.391 0.677 . . . . 71.04 110.407 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -98.91 2.18 46.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.005 0.922 . . . . 73.33 111.576 174.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -69.64 135.4 26.82 Favored Glycine 0 C--N 1.343 0.963 0 O-C-N 123.483 0.489 . . . . 71.22 112.614 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.596 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -151.02 -173.12 4.39 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.564 0.745 . . . . 72.31 109.068 -176.452 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -63.62 90.14 0.05 Allowed 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.522 0.729 . . . . 75.23 109.521 174.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.0 m -104.08 170.38 7.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.381 -1.281 . . . . 75.4 108.575 176.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.9 t -113.4 90.76 17.97 Favored Pre-proline 0 CA--C 1.551 0.985 0 N-CA-C 108.615 -0.883 . . . . 74.51 108.615 177.162 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -84.81 150.31 11.18 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.666 2.244 . . . . 74.25 112.327 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m -73.52 163.39 28.1 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.917 0.487 . . . . 73.54 110.389 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.47 -32.14 73.32 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 110.168 -0.308 . . . . 72.11 110.168 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -71.77 -30.87 66.03 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.487 0.315 . . . . 74.31 111.132 175.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.1 -51.21 57.08 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 107.883 -1.155 . . . . 73.44 107.883 176.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.1 m -58.06 -47.59 82.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.454 1.102 . . . . 75.14 111.198 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.4 m -65.88 -40.9 92.04 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.768 0.827 . . . . 75.23 111.14 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.48 -41.68 96.34 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.803 0.441 . . . . 74.14 110.283 177.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.51 -26.67 64.65 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.105 0.562 . . . . 64.1 111.261 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.519 ' HA ' ' HE2' ' A' ' 66' ' ' LYS . 84.8 m-20 -76.44 -38.28 55.73 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.466 0.706 . . . . 73.34 110.632 176.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.19 -39.51 78.64 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.737 0.815 . . . . 74.33 109.811 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.414 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -67.62 -49.0 65.17 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.286 1.034 . . . . 72.24 109.014 -177.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.519 ' HE2' ' HA ' ' A' ' 63' ' ' ASN . 37.1 ttpt -55.59 -46.1 77.3 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.054 1.342 . . . . 74.13 111.754 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.41 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -70.56 -32.22 69.55 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.463 0.705 . . . . 75.11 111.454 -177.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.484 ' HB2' HD11 ' A' ' 105' ' ' LEU . . . -71.02 -32.43 69.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.356 0.662 . . . . 74.31 109.885 175.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 95.1 mt -73.11 -27.59 61.78 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.595 -0.73 . . . . 74.21 110.502 173.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -66.55 -41.78 88.16 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.777 0.431 . . . . 74.03 110.637 171.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 16.5 mm-40 -60.58 -49.29 78.13 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.63 0.581 . . . . 72.33 109.977 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.496 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.18 -46.8 88.47 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.9 0.75 . . . . 73.42 111.264 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.19 -47.53 78.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.5 1.12 . . . . 74.23 110.599 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.73 -37.73 94.72 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.083 -0.962 . . . . 63.2 112.878 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -61.46 -53.07 61.3 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.0 0.52 . . . . 72.21 110.978 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.555 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -69.12 -20.31 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 N-CA-C 112.239 0.459 . . . . 75.11 112.239 179.305 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -67.26 -41.03 86.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.262 0.553 . . . . 71.52 111.055 168.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -71.97 -30.23 65.06 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.127 -0.942 . . . . 73.42 110.816 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.539 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.4 m-85 -83.97 -8.17 59.22 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.741 0.817 . . . . 74.31 112.271 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 9.1 t -61.9 -22.11 65.3 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.241 0.543 . . . . 73.45 110.291 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -86.05 108.55 18.31 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.212 -1.033 . . . . 73.12 108.212 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -75.54 -23.84 56.67 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.864 0.465 . . . . 74.35 110.595 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.1 m -67.9 -35.0 77.72 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.131 0.572 . . . . 74.42 110.58 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -64.07 -38.3 90.58 Favored 'General case' 0 C--O 1.25 1.11 0 C-N-CA 123.209 0.604 . . . . 73.33 110.096 175.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.483 HG21 HD11 ' A' ' 97' ' ' LEU . 32.8 mt -59.81 -56.73 15.42 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 123.816 0.698 . . . . 74.43 109.177 174.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -56.54 -38.22 71.56 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.361 0.664 . . . . 74.12 111.762 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 ttm180 -56.05 -59.18 5.28 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 124.664 1.228 . . . . 75.51 111.028 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.75 -25.6 56.67 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 116.058 -0.519 . . . . 75.42 110.206 -175.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.409 HD21 HE21 ' A' ' 149' ' ' GLN . 16.6 tp -74.13 -41.33 61.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.547 0.739 . . . . 74.51 110.03 -169.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -66.17 -22.76 66.37 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 123.434 0.459 . . . . 73.4 110.598 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 -28.91 19.2 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.056 0.943 . . . . 64.04 111.546 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.4 p -81.16 102.78 10.52 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.917 0.487 . . . . 71.04 111.34 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -74.52 -1.37 21.04 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.491 0.716 . . . . 71.14 110.885 171.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.27 -39.97 93.29 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.175 0.99 . . . . 71.11 110.912 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.471 ' HG2' ' HA ' ' A' ' 142' ' ' ASP . 0.0 OUTLIER 74.36 -53.05 0.68 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 126.289 1.835 . . . . 75.41 111.548 -170.071 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.405 HD11 ' HA ' ' A' ' 138' ' ' GLN . 3.0 mp -67.56 116.29 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.664 -0.865 . . . . 65.11 108.664 -177.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.605 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 9.3 tp -56.48 -30.37 62.87 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 124.329 1.018 . . . . 71.34 112.074 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.555 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 28.1 m-85 -121.57 26.94 8.5 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 114.616 -1.174 . . . . 74.54 111.716 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -40.03 -63.71 0.58 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.398 1.079 . . . . 74.34 112.183 -169.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.48 -61.55 2.51 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.581 1.152 . . . . 72.13 111.86 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 96.9 t -59.79 -56.32 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.681 1.192 . . . . 72.21 111.685 -172.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.45 ' HB2' ' HB3' ' A' ' 98' ' ' PHE . 50.7 t30 -61.07 -33.63 73.64 Favored 'General case' 0 C--O 1.245 0.864 0 C-N-CA 124.926 1.29 . . . . 74.33 112.517 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -41.36 97.31 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 109.47 -0.567 . . . . 75.31 109.47 172.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -68.85 -31.9 71.19 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.786 -0.643 . . . . 73.44 112.442 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.484 HD11 ' HB2' ' A' ' 68' ' ' ALA . 10.4 mp -58.81 -49.36 78.0 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.533 -0.543 . . . . 73.51 109.533 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.7 t -66.51 -32.77 74.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.806 0.842 . . . . 72.45 111.52 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.529 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 15.0 t70 -70.19 -51.39 31.47 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.656 0.783 . . . . 74.32 110.433 -178.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.5 -27.67 37.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-N 116.042 -0.526 . . . . 73.1 110.337 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 48.5 t-105 -69.42 -37.15 77.3 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 122.804 0.442 . . . . 75.34 111.462 174.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 32.5 pttt -66.49 -40.04 89.07 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 108.217 -1.031 . . . . 74.21 108.217 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 42.0 mt-10 -60.56 -47.96 83.87 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 123.526 0.516 . . . . 74.34 110.41 174.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.51 -61.36 2.46 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 124.842 1.339 . . . . 75.51 108.718 -177.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.4 t -49.26 -43.41 42.92 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.03 1.332 . . . . 72.33 111.274 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -58.3 -66.15 0.53 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 123.832 0.708 . . . . 74.43 111.896 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.9 pp -62.93 -27.68 69.55 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.241 0.46 . . . . 74.41 112.241 -172.02 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HB3' ' HE2' ' A' ' 122' ' ' MET . 95.1 mt -70.69 -48.36 55.11 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.067 0.947 . . . . 73.44 110.673 176.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -78.83 -20.68 49.06 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.508 0.323 . . . . 74.13 111.644 -175.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 98.1 t -81.1 -55.38 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 110.014 -0.365 . . . . 63.51 110.014 177.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -87.56 -58.52 2.55 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 111.729 0.27 . . . . 62.21 111.729 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -76.81 -8.02 56.53 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.417 0.287 . . . . 74.52 111.239 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 58.31 32.88 22.6 Favored 'General case' 0 C--N 1.36 1.027 0 C-N-CA 124.621 1.168 . . . . 74.44 111.243 177.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.477 ' HE2' ' HB3' ' A' ' 116' ' ' LEU . 35.0 ttm -72.24 124.92 91.47 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 114.93 -1.032 . . . . 75.12 110.921 -174.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.46 79.61 3.28 Favored 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.463 2.109 . . . . 74.53 110.984 178.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.404 HG23 ' HG3' ' A' ' 41' ' ' PRO . 12.9 p -145.16 112.8 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.595 -0.729 . . . . 74.34 110.158 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.3 t -169.78 71.2 0.65 Allowed Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.62 1.168 . . . . 73.14 108.448 171.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -88.78 32.06 0.39 Allowed 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 123.019 2.48 . . . . 74.32 110.959 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 9.8 tt -154.3 -38.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.698 0 C-N-CA 124.347 1.059 . . . . 74.45 109.975 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.9 m 65.48 -76.56 0.04 OUTLIER 'General case' 0 C--N 1.359 0.998 0 C-N-CA 125.418 1.487 . . . . 60.01 111.885 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.1 20.55 1.93 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.932 0.493 . . . . 74.34 109.873 -178.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 78.1 36.74 30.71 Favored Glycine 0 C--N 1.343 0.954 0 O-C-N 122.097 -0.377 . . . . 72.41 113.047 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.33 -55.44 24.59 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.387 0.675 . . . . 65.21 110.809 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.414 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 20.7 m -72.39 -42.2 65.47 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.679 -0.691 . . . . 75.31 110.577 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.7 m0 -56.29 -25.21 47.53 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 114.258 1.207 . . . . 75.43 114.258 -170.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.44 -39.48 46.67 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.672 0.272 . . . . 73.44 110.981 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -67.37 -47.73 69.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.656 0.782 . . . . 74.01 110.181 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 132' ' ' SER . 13.7 mm-40 -57.45 -63.04 1.37 Allowed 'General case' 0 C--N 1.355 0.809 0 CA-C-N 114.412 -1.267 . . . . 73.15 110.636 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -56.21 -38.66 71.31 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.736 1.272 . . . . 74.21 112.66 -176.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.405 ' HA ' HD11 ' A' ' 96' ' ' ILE . 6.4 tp-100 -58.18 -60.42 3.78 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.085 0.865 . . . . 75.53 110.43 178.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -68.73 -39.63 80.27 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.562 -0.745 . . . . 75.34 111.362 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.93 -57.98 10.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.929 1.692 . . . . 72.51 110.029 -177.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -75.29 -25.03 57.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 114.226 -1.352 . . . . 74.12 112.252 -174.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.471 ' HA ' ' HG2' ' A' ' 95' ' ' LYS . 22.0 t70 -61.09 -56.05 25.38 Favored 'General case' 0 C--N 1.349 0.58 0 O-C-N 123.724 0.64 . . . . 72.11 109.315 172.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.84 -33.36 75.8 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.488 1.117 . . . . 74.3 111.695 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.533 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 25.5 t0 -74.15 -32.63 63.22 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.197 0.311 . . . . 74.23 111.114 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -67.07 -37.05 83.31 Favored 'General case' 0 C--N 1.355 0.81 0 N-CA-C 109.222 -0.658 . . . . 73.44 109.222 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 10.8 mmt180 -63.77 -44.1 94.42 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.558 -0.534 . . . . 75.22 109.558 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.93 74.59 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.716 0.806 . . . . 73.32 111.862 -176.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.46 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -76.47 -61.65 1.89 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 109.842 -0.429 . . . . 75.43 109.842 178.926 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . 0.409 HE21 HD21 ' A' ' 89' ' ' LEU . 86.7 mm-40 -68.82 -33.04 73.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.62 0.768 . . . . 74.42 111.173 -170.532 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.9 ttm -117.18 80.28 1.46 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.537 -1.282 . . . . 73.02 107.537 171.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.53 HD12 ' HA ' ' A' ' 155' ' ' ASN . 26.1 tp -84.36 69.12 10.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 122.115 0.96 . . . . 74.24 108.479 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.78 48.6 1.43 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 105.883 -1.895 . . . . 75.13 105.883 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -125.62 4.22 7.53 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.558 -1.656 . . . . 71.11 109.081 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 55.46 27.98 10.97 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.392 1.077 . . . . 75.54 111.416 -169.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.53 ' HA ' HD12 ' A' ' 151' ' ' LEU . 5.9 t30 74.36 -25.88 0.2 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.04 1.336 . . . . 73.33 114.245 171.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 . . . . . 0 CA--C 1.559 1.316 0 C-N-CA 125.226 1.411 . . . . 72.31 110.614 -170.134 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttp . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.555 0.693 . . . . 75.34 109.501 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -66.85 -44.06 82.0 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.74 0.816 . . . . 61.4 110.583 -173.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.538 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 59.9 m-20 -56.38 -53.86 52.39 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 124.059 0.85 . . . . 74.03 110.784 175.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.7 mt -56.57 -46.36 80.82 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.999 0.812 . . . . 74.03 111.804 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -54.79 -47.61 73.77 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.618 0.574 . . . . 74.11 110.707 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -69.46 -42.17 75.24 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 118.826 -0.607 . . . . 75.35 112.415 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.08 -43.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 123.829 0.852 . . . . 75.02 110.514 -177.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 29.5 mm -67.69 -42.84 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.029 -0.987 . . . . 73.31 110.471 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.2 m -60.68 -48.98 79.34 Favored 'General case' 0 C--N 1.357 0.91 0 O-C-N 123.523 0.515 . . . . 61.33 110.539 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -55.12 -49.97 70.42 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 123.995 0.918 . . . . 75.54 110.119 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.96 -48.45 79.01 Favored Glycine 0 C--N 1.343 0.92 0 O-C-N 124.844 1.34 . . . . 74.24 112.973 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.405 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.1 mt-30 -62.44 -49.38 75.68 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.799 0.44 . . . . 73.5 111.284 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.9 -34.92 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.891 0.877 . . . . 71.21 110.764 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.459 HD13 ' O ' ' A' ' 69' ' ' LEU . 8.6 mt -62.92 -48.27 88.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.824 1.25 . . . . 75.34 110.505 177.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -62.76 -36.58 83.51 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 123.994 0.809 . . . . 74.34 110.355 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.405 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.8 mmmt -66.24 -48.17 71.4 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.669 0.605 . . . . 75.52 112.083 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -77.66 -17.99 57.16 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.346 0.258 . . . . 75.12 111.646 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' SG ' HD21 ' A' ' 31' ' ' LEU . 53.0 t -71.33 -22.24 61.94 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.58 0.752 . . . . 71.44 111.031 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.48 -16.69 64.31 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.722 0.409 . . . . 73.43 111.3 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -68.62 -17.18 64.06 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.124 0.57 . . . . 74.32 112.325 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.496 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 5.7 mmt -76.74 83.29 3.35 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.596 -0.52 . . . . 72.22 109.596 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -40.97 72.75 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.703 -1.221 . . . . 73.43 107.703 174.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -92.77 154.53 18.23 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.239 -1.346 . . . . 73.32 108.543 170.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 80.9 m 58.97 58.83 3.02 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.977 0.894 . . . . 71.22 109.344 -171.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -73.36 -34.39 65.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 114.199 -1.364 . . . . 71.52 111.472 -169.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HB3' ' HZ2' ' A' ' 26' ' ' LYS . 5.0 mtpm? -81.74 -27.66 33.72 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.047 -0.723 . . . . 52.21 109.047 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.664 ' HG3' ' HG ' ' A' ' 97' ' ' LEU . 27.4 mm-40 -61.28 -40.65 94.92 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.423 0.689 . . . . 65.12 110.537 165.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 42.5 t -65.55 -36.17 83.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.692 0.797 . . . . 60.2 110.982 176.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -71.97 -31.95 66.78 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.207 0.603 . . . . 75.12 110.92 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 136' ' ' GLU . 21.5 mmt180 -69.14 -52.33 29.22 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.782 0.433 . . . . 73.31 110.373 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.442 HD21 ' SG ' ' A' ' 18' ' ' CYS . 29.7 tp -65.3 -38.85 91.49 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.62 0.575 . . . . 71.53 110.243 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.87 -54.41 38.2 Favored Glycine 0 C--N 1.346 1.111 0 O-C-N 123.691 0.619 . . . . 74.31 112.915 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -64.6 -44.37 90.83 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.848 0.859 . . . . 73.44 110.781 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.487 ' HG2' ' CE2' ' A' ' 133' ' ' TRP . 39.5 mtm180 -57.78 -60.6 3.45 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.084 0.865 . . . . 74.01 110.406 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.09 -51.58 69.08 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.576 0 O-C-N 124.311 1.007 . . . . 75.0 112.1 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.6 -45.65 93.21 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 118.064 0.393 . . . . 74.42 111.01 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -73.18 -18.36 79.19 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.943 -0.571 . . . . 72.34 113.448 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 12.6 tp -87.35 -40.01 14.82 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.52 0.728 . . . . 75.42 111.124 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.415 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 11.8 pt -79.73 -34.56 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 119.058 -0.496 . . . . 74.33 110.361 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -53.68 -50.64 82.34 Favored Pre-proline 0 CA--C 1.562 1.414 0 CA-C-O 117.929 -1.034 . . . . 75.02 113.415 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.636 ' HA ' ' HE2' ' A' ' 44' ' ' MET . 19.3 Cg_endo -58.64 -39.84 78.96 Favored 'Trans proline' 0 C--N 1.4 3.265 0 C-N-CA 121.699 1.6 . . . . 74.44 112.265 177.098 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.654 HD13 HD22 ' A' ' 45' ' ' LEU . 4.0 mm? -69.48 -31.99 70.61 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.62 -0.718 . . . . 72.45 111.072 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 52.6 mt-10 -70.31 -38.9 75.05 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.065 0.546 . . . . 73.23 111.153 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.636 ' HE2' ' HA ' ' A' ' 41' ' ' PRO . 66.0 mtm -61.77 -46.13 90.92 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 123.625 0.578 . . . . 73.4 111.47 -179.27 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.654 HD22 HD13 ' A' ' 42' ' ' LEU . 3.7 pp -75.25 -33.06 61.25 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 116.323 -0.399 . . . . 75.23 111.007 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.7 -32.95 74.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.148 0.579 . . . . 74.22 110.572 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.65 -45.37 59.28 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.936 0.894 . . . . 74.41 111.902 -179.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -100.53 -51.67 3.55 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 111.91 0.337 . . . . 71.45 111.91 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.89 70.77 3.07 Favored Glycine 0 C--N 1.345 1.042 0 N-CA-C 111.971 -0.452 . . . . 72.33 111.971 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -84.66 65.67 9.17 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.863 0.865 . . . . 71.23 109.579 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 78.0 mtp180 -92.22 156.95 16.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.963 0.905 . . . . 72.34 111.328 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.0 m -106.96 -163.71 0.93 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.967 0.907 . . . . 70.35 109.85 173.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 p 38.75 75.06 0.59 Allowed Pre-proline 0 CA--C 1.569 1.693 0 C-N-CA 126.014 1.726 . . . . 74.43 113.762 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -81.6 151.31 17.1 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.713 2.275 . . . . 74.22 111.763 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.515 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 28.9 m -66.25 152.89 43.94 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.252 0.621 . . . . 74.1 111.033 176.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -61.07 -45.28 95.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.128 0.571 . . . . 72.34 111.111 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -59.08 -41.38 87.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.088 0.555 . . . . 75.4 110.878 176.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 55' ' ' SER . 12.2 tp -65.53 -48.77 71.34 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.641 -1.163 . . . . 74.14 110.151 -172.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.2 m -67.28 -39.27 86.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 114.915 -1.039 . . . . 74.53 111.05 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.9 m -65.62 -36.9 85.05 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.145 0.578 . . . . 64.14 111.256 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.28 -45.51 84.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.186 0.595 . . . . 74.21 109.774 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.538 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.8 mmt -68.71 -20.87 64.42 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.034 -0.985 . . . . 72.41 112.327 176.217 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -74.62 -42.86 57.85 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.242 0.617 . . . . 74.42 109.905 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.15 -41.5 98.34 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.287 0.635 . . . . 74.3 109.827 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.406 ' O ' HD21 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -64.9 -50.99 64.34 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.396 -1.274 . . . . 74.31 109.75 -177.023 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -53.62 -49.37 67.99 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.311 1.044 . . . . 73.2 110.357 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.76 80.11 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.315 1.009 . . . . 75.0 111.773 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.479 ' HB3' HD11 ' A' ' 105' ' ' LEU . . . -66.59 -43.04 85.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.303 0.641 . . . . 61.42 110.862 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.459 ' O ' HD13 ' A' ' 14' ' ' ILE . 4.2 mm? -70.36 -25.82 63.44 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.365 0.666 . . . . 75.35 111.559 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -65.25 -50.45 65.73 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.078 0.466 . . . . 64.21 109.949 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -64.61 -38.96 92.8 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 114.96 -1.018 . . . . 65.54 110.746 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.409 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.72 -47.33 85.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.082 0.553 . . . . 70.53 110.904 176.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.67 -38.46 81.55 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.155 0.91 . . . . 73.31 110.814 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.36 -42.04 75.79 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 123.962 0.789 . . . . 63.33 113.118 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.08 -41.59 94.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 122.605 0.362 . . . . 72.23 111.073 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.531 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 4.3 pt -80.76 -18.5 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.502 0.556 . . . . 63.52 112.502 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -64.68 -33.69 76.54 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.127 -0.694 . . . . 74.12 109.127 165.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -76.75 -39.53 51.44 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.754 -0.657 . . . . 74.05 110.894 173.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.531 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.4 m-30 -74.11 -12.4 60.59 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 112.867 0.692 . . . . 72.42 112.867 -177.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.2 p -61.0 -31.12 70.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.024 0.44 . . . . 70.13 110.276 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -89.65 115.87 27.35 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.179 -1.045 . . . . 74.5 108.179 167.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -74.35 -25.13 59.34 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.784 0.834 . . . . 73.31 110.992 -172.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -68.71 -34.45 75.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.628 0.771 . . . . 73.3 110.31 174.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.9 -35.54 74.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.398 0.679 . . . . 72.22 110.359 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.453 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.5 mt -58.65 -58.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 N-CA-C 108.827 -0.805 . . . . 75.2 108.827 171.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.0 t -53.0 -37.98 61.92 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.005 0.922 . . . . 70.53 111.825 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -62.6 -52.26 64.07 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-N 115.123 -0.944 . . . . 75.04 111.266 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -28.94 64.41 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.146 -0.316 . . . . 75.33 110.146 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.52 HD13 ' HG2' ' A' ' 145' ' ' ARG . 11.5 tp -74.81 -39.36 61.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.695 1.198 . . . . 72.42 111.524 -166.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -67.22 -22.94 65.69 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.235 -0.893 . . . . 72.13 110.661 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.3 -10.2 17.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.509 0.724 . . . . 64.13 112.149 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 92.2 p -71.08 125.2 26.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.682 0.393 . . . . 73.14 110.139 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -74.43 -35.09 63.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.216 0.606 . . . . 70.1 110.172 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -83.86 170.8 13.71 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.749 0.785 . . . . 73.42 110.884 169.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.451 ' HA ' ' HG3' ' A' ' 145' ' ' ARG . 89.4 mttt -105.44 -29.01 10.49 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.436 -1.256 . . . . 71.22 110.263 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.5 mp -74.76 126.89 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 108.593 -0.892 . . . . 74.41 108.593 -176.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.664 ' HG ' ' HG3' ' A' ' 27' ' ' GLN . 15.5 mt -65.19 -38.98 92.2 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 122.173 0.987 . . . . 75.44 110.093 177.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.412 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 56.7 m-85 -107.07 43.86 1.12 Allowed 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 113.715 -1.584 . . . . 73.34 109.445 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -63.46 -64.81 0.8 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.357 -0.979 . . . . 73.55 108.357 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.74 -42.82 85.65 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.785 -1.098 . . . . 74.34 110.302 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.476 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 50.0 t -59.65 -54.74 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 124.149 0.906 . . . . 73.13 111.278 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -72.07 -25.82 61.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 119.186 -0.435 . . . . 74.24 110.727 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -61.0 -43.93 98.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 109.815 -0.439 . . . . 75.34 109.815 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.476 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 42.5 mttm -60.36 -57.45 12.72 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.902 0.881 . . . . 73.34 110.744 175.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.479 HD11 ' HB3' ' A' ' 68' ' ' ALA . 10.2 mp -54.6 -41.0 69.43 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.9 0.75 . . . . 75.12 111.348 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.2 t -71.64 -42.11 67.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.346 0.658 . . . . 61.31 111.264 -176.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.733 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 17.7 t70 -71.93 -44.96 62.77 Favored 'General case' 0 C--O 1.254 1.305 0 O-C-N 123.623 0.577 . . . . 63.1 110.718 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.7 t -58.57 -49.74 81.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 CA-C-N 115.003 -0.999 . . . . 74.33 109.173 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -64.16 -29.07 70.21 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.011 0.819 . . . . 73.22 111.83 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.733 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 40.8 mtpt -56.69 -67.69 0.29 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 108.54 -0.911 . . . . 72.43 108.54 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.16 -29.84 71.11 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 124.084 0.865 . . . . 71.44 111.902 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.497 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.3 tt -72.52 -50.21 27.38 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.622 0.769 . . . . 75.54 110.142 -175.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.4 p -62.08 -37.6 85.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.446 0.298 . . . . 74.31 110.689 177.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 94.1 mt -60.11 -44.62 94.72 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.372 -0.831 . . . . 74.52 111.701 176.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -78.49 -21.8 48.43 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 112.23 0.456 . . . . 75.34 112.23 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 84.7 mt -63.97 -43.19 96.53 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.918 -0.771 . . . . 75.25 108.918 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.43 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.69 -47.47 66.34 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.698 0.799 . . . . 72.32 112.269 175.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.2 t -64.19 -60.65 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.23 0.612 . . . . 73.32 111.372 -177.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -86.32 -54.47 4.42 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.797 -0.638 . . . . 75.13 111.37 -168.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -88.37 -6.27 57.81 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.503 0.557 . . . . 75.01 112.503 -175.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 52.7 ttt85 66.16 7.57 4.91 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.854 1.262 . . . . 72.33 112.771 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 37.1 mtp -65.46 118.34 49.63 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.258 1.023 . . . . 65.52 111.423 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -81.82 51.61 3.9 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.612 2.874 . . . . 71.14 112.559 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.13 105.68 11.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.731 0.813 . . . . 75.34 109.882 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.0 t -148.24 68.12 10.16 Favored Pre-proline 0 CA--C 1.55 0.96 0 CA-C-N 115.753 -0.658 . . . . 73.11 110.013 176.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.61 7.85 4.96 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.567 2.178 . . . . 72.34 112.563 177.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.43 HD11 ' HA2' ' A' ' 130' ' ' GLY . 17.8 tt -147.21 -31.0 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 124.169 0.988 . . . . 75.13 110.236 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 19.7 m 73.04 -65.93 0.33 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.415 1.486 . . . . 75.41 112.316 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -72.34 -67.68 0.53 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.021 0.528 . . . . 72.22 111.435 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.43 ' HA2' HD11 ' A' ' 127' ' ' ILE . . . 90.38 -29.8 6.42 Favored Glycine 0 N--CA 1.48 1.568 0 N-CA-C 112.666 -0.173 . . . . 73.32 112.666 -176.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.03 -13.36 60.23 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.4 1.08 . . . . 53.32 111.306 172.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.5 m -46.4 -40.17 11.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.125 1.37 . . . . 74.25 112.338 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.487 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 37.3 m0 -60.28 -32.64 71.37 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 114.653 -1.158 . . . . 74.12 113.141 -177.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.46 -27.97 69.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.749 0.42 . . . . 64.14 111.612 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -88.81 -46.6 8.83 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.636 0.774 . . . . 75.33 110.705 174.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.477 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 49.8 mt-10 -64.11 -62.56 1.55 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.152 0.981 . . . . 72.22 111.6 -174.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -53.84 -34.07 58.18 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.871 0.869 . . . . 72.34 111.895 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -67.13 -52.04 46.56 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.109 0.564 . . . . 73.24 112.216 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.74 -48.69 80.67 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.556 0.535 . . . . 74.4 109.902 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.47 -38.31 86.8 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 114.248 -1.342 . . . . 64.23 110.313 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.0 97.6 Favored 'General case' 0 C--O 1.22 -0.46 0 O-C-N 124.121 0.888 . . . . 73.14 112.374 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.33 -47.78 84.36 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 109.181 -0.674 . . . . 74.35 109.181 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.93 -48.25 82.13 Favored 'General case' 0 CA--C 1.555 1.141 0 O-C-N 124.389 1.055 . . . . 74.11 111.35 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -70.33 -56.11 7.51 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.079 0.952 . . . . 75.14 112.378 -176.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.52 ' HG2' HD13 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -62.11 -43.07 99.65 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.318 1.047 . . . . 72.32 109.738 -173.696 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -63.45 -49.76 72.4 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 123.971 0.794 . . . . 75.43 109.632 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.73 70.71 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 112.312 0.486 . . . . 72.11 112.312 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -45.62 60.27 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.31 0.644 . . . . 70.42 109.555 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -76.51 -13.25 60.11 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 115.754 -0.657 . . . . 75.13 112.096 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 48.8 mtm -97.57 -77.59 0.5 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.084 -0.709 . . . . 74.41 109.084 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 95.8 mt 61.63 178.69 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.907 1.283 . . . . 71.45 111.663 -172.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -166.33 42.7 0.06 Allowed 'General case' 0 N--CA 1.484 1.229 0 CA-C-O 121.572 0.701 . . . . 74.31 110.862 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -136.19 -59.56 0.74 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.865 0.866 . . . . 75.22 109.766 175.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -122.12 28.73 7.36 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.184 0.994 . . . . 63.4 109.857 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -107.27 130.02 54.81 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.764 0.826 . . . . 75.04 109.924 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 . . . . . 0 CA--C 1.554 1.129 0 C-N-CA 124.194 0.998 . . . . 73.15 109.004 173.378 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.419 ' HE1' ' HB3' ' A' ' 1' ' ' MET . 32.3 ttp . . . . . 0 N--CA 1.496 1.873 0 CA-C-O 120.878 0.371 . . . . 70.11 110.197 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -30.05 34.28 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.902 0.881 . . . . 75.32 111.515 171.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -55.42 -45.05 76.75 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.857 0.863 . . . . 72.1 110.535 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.517 HD23 ' HZ2' ' A' ' 50' ' ' LYS . 4.1 mm? -65.12 -41.53 94.77 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.364 -0.834 . . . . 73.3 110.69 177.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -57.19 -43.4 82.63 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.746 0.654 . . . . 75.53 110.862 177.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -60.71 -55.71 29.95 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.619 0.574 . . . . 72.32 110.584 178.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.26 -49.39 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.817 0.847 . . . . 73.33 111.761 -177.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 80.5 mt -71.12 -43.59 75.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.708 1.203 . . . . 73.41 111.197 -172.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.421 ' O ' HG23 ' A' ' 13' ' ' VAL . 97.5 m -63.45 -48.88 75.89 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.697 0.399 . . . . 72.41 110.536 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.1 mt -53.71 -50.36 66.07 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.05 0.843 . . . . 75.34 110.471 177.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.69 -52.31 46.56 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 124.602 1.189 . . . . 75.11 112.996 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.69 -48.24 82.45 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.773 0.429 . . . . 64.24 111.463 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 9' ' ' THR . 46.5 t -68.34 -25.24 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.086 0.554 . . . . 73.41 111.061 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.464 HD11 ' O ' ' A' ' 69' ' ' LEU . 33.4 mt -64.43 -48.4 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.83 0.852 . . . . 71.33 109.181 172.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.411 ' HB2' HG11 ' A' ' 35' ' ' VAL . 38.9 t-80 -59.37 -37.71 78.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.404 0.681 . . . . 74.03 111.134 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -63.75 -59.02 5.1 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.804 0.69 . . . . 74.23 110.966 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -74.69 -16.82 60.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.063 0.545 . . . . 75.31 111.755 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.63 -23.22 65.32 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.365 0.666 . . . . 73.11 111.289 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.96 -8.52 53.7 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.165 0.586 . . . . 73.33 111.653 178.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.85 -23.27 67.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.597 0.359 . . . . 63.01 111.153 170.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.432 ' HE3' HG23 ' A' ' 76' ' ' ILE . 7.2 mmt -74.88 87.44 2.28 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.697 -0.853 . . . . 72.3 108.697 176.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -36.09 75.13 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 107.359 -1.348 . . . . 72.53 107.359 168.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -89.72 175.91 7.06 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.622 -1.172 . . . . 74.21 108.454 171.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.61 ' SG ' HG23 ' A' ' 85' ' ' ILE . 99.9 m 57.79 74.03 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.796 0.685 . . . . 61.23 110.405 -172.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.76 -60.44 3.09 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.731 1.212 . . . . 74.13 110.585 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 57.5 mmtt -63.67 -49.46 73.07 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 115.145 -0.934 . . . . 75.24 110.381 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 14.0 mt-30 -60.55 -34.91 74.83 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.1 0.56 . . . . 75.23 112.243 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.4 t -74.21 -44.43 53.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.619 0.368 . . . . 72.14 110.948 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -65.79 -38.82 90.05 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 122.713 0.405 . . . . 75.11 110.911 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.508 ' NH2' ' HA ' ' A' ' 137' ' ' ASP . 18.2 mtp180 -67.9 -38.47 83.01 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.123 0.969 . . . . 64.03 110.627 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER -60.05 -50.81 72.24 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.995 0.81 . . . . 75.13 108.91 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -40.2 97.31 Favored Glycine 0 C--N 1.348 1.211 0 O-C-N 123.971 0.795 . . . . 71.12 113.202 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -57.0 -47.76 80.05 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.35 1.06 . . . . 74.43 110.71 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 69.5 mtt-85 -64.68 -48.78 73.47 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 114.726 -1.124 . . . . 73.41 110.753 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.411 HG11 ' HB2' ' A' ' 15' ' ' HIS . 41.7 t -54.09 -61.62 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.518 0 O-C-N 124.148 0.905 . . . . 73.15 111.185 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.481 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 72.2 mt -65.39 -46.42 80.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.074 0.859 . . . . 70.22 110.564 -172.329 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -37.78 76.97 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 116.058 -0.519 . . . . 74.3 113.069 176.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.467 HD22 ' HE1' ' A' ' 65' ' ' PHE . 18.0 tp -84.33 -38.13 20.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.853 0.861 . . . . 73.45 112.471 -173.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.433 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 16.3 pt -75.46 -37.45 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 119.42 -0.324 . . . . 74.2 110.871 -176.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.481 ' HD3' ' O ' ' A' ' 36' ' ' LEU . 5.6 mptp? -51.7 -51.81 66.59 Favored Pre-proline 0 N--CA 1.485 1.296 0 N-CA-C 114.021 1.119 . . . . 75.11 114.021 -174.501 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 19.6 Cg_endo -55.43 -37.52 94.74 Favored 'Trans proline' 0 C--N 1.395 3.007 0 C-N-CA 122.357 2.038 . . . . 73.21 112.669 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 -40.77 76.19 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.377 0.671 . . . . 72.33 110.658 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 92.7 mt-10 -66.74 -37.13 84.04 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.405 1.082 . . . . 74.42 111.299 -179.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.46 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 34.6 mmt -65.76 -40.15 91.77 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.728 0.642 . . . . 71.55 110.431 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -76.82 -38.26 54.18 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.281 -0.418 . . . . 72.03 110.403 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -39.2 87.65 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.485 0.714 . . . . 74.25 111.67 -178.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -71.86 -40.79 68.74 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.866 0.866 . . . . 73.02 110.899 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -86.11 -61.13 1.82 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.079 -0.509 . . . . 72.24 111.138 -176.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 172.79 86.18 0.06 OUTLIER Glycine 0 C--N 1.337 0.628 0 N-CA-C 112.256 -0.338 . . . . 73.11 112.256 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.517 ' HZ2' HD23 ' A' ' 4' ' ' LEU . 63.3 tttm -90.65 159.73 16.25 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.425 0.69 . . . . 75.53 109.813 176.274 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.576 ' HG3' HE21 ' A' ' 120' ' ' GLN . 41.1 mmt180 -47.76 96.37 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.222 1.409 . . . . 74.13 111.836 175.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.4 m -72.03 -43.29 65.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.634 -1.166 . . . . 71.54 109.655 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 t -113.72 89.68 16.51 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 107.758 -1.201 . . . . 75.31 107.758 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.459 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 36.4 Cg_endo -91.65 -167.56 0.21 Allowed 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 123.041 2.494 . . . . 75.44 112.587 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.3 m -83.83 166.24 18.12 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.217 0.607 . . . . 74.3 109.684 172.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -59.98 -38.29 82.12 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.958 0.503 . . . . 74.52 110.735 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HG3' HD21 ' A' ' 58' ' ' LEU . 61.8 pttt -62.42 -37.27 85.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.371 0.668 . . . . 71.5 111.626 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.622 HD13 HD12 ' A' ' 115' ' ' LEU . 4.0 mm? -65.96 -51.12 61.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.674 0.39 . . . . 74.1 110.172 175.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.5 m -58.67 -45.42 89.42 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.11 0.881 . . . . 71.42 111.229 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 51.0 m -59.73 -44.89 93.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.875 0.87 . . . . 74.32 110.212 176.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.67 -44.44 96.47 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.706 0.629 . . . . 75.41 111.494 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.401 ' HE1' ' HA ' ' A' ' 62' ' ' MET . 4.6 mmt -67.45 -31.47 71.66 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.82 0.848 . . . . 62.5 111.141 179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -74.29 -44.9 50.78 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.677 0.791 . . . . 73.22 111.057 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -61.25 -44.2 97.63 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.768 0.827 . . . . 73.14 109.727 175.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.467 ' HE1' HD22 ' A' ' 38' ' ' LEU . 3.4 t80 -59.62 -58.13 9.93 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 113.533 -1.667 . . . . 63.23 109.958 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.495 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.9 ttpp -52.71 -45.53 66.93 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 124.6 1.187 . . . . 73.2 110.913 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.82 79.03 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 124.311 1.007 . . . . 70.53 111.785 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.15 -34.8 71.34 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.339 0.656 . . . . 72.01 111.737 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.464 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -63.84 -40.12 95.84 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 122.554 0.342 . . . . 64.24 110.737 170.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 37.5 mt-10 -63.4 -42.07 98.77 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.151 0.58 . . . . 73.05 110.413 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 39.1 mt-10 -58.26 -54.65 44.65 Favored 'General case' 0 C--N 1.355 0.837 0 CA-C-N 114.907 -1.042 . . . . 74.11 110.124 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.19 -43.67 78.67 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.569 1.168 . . . . 74.41 111.884 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.06 -51.64 68.48 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 124.68 1.237 . . . . 75.15 109.854 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.04 -31.31 80.48 Favored Glycine 0 CA--C 1.535 1.282 0 CA-C-N 115.036 -0.984 . . . . 71.21 114.171 178.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.555 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 29.8 mm-40 -67.65 -56.42 9.45 Favored 'General case' 0 C--N 1.356 0.879 0 CA-C-N 116.947 0.373 . . . . 74.35 110.396 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.531 HG22 ' CZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -59.29 -28.26 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.937 -0.477 . . . . 74.43 111.43 175.557 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.07 -46.52 89.31 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.037 0.384 . . . . 74.23 112.037 171.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.555 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 14.1 ptpt -73.77 -25.29 60.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 117.852 0.296 . . . . 73.32 110.87 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.58 -2.41 57.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.541 0.736 . . . . 74.35 112.851 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.9 p -57.13 -31.14 65.02 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.978 0.511 . . . . 74.44 111.189 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -83.83 115.51 22.28 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 107.913 -1.143 . . . . 63.52 107.913 165.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -74.3 -23.02 59.03 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.482 0.713 . . . . 64.0 111.083 -172.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.8 p -59.82 -32.34 70.56 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.071 0.948 . . . . 71.53 111.765 171.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -63.17 -42.28 99.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.423 0.689 . . . . 71.44 110.327 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.61 HG23 ' SG ' ' A' ' 24' ' ' CYS . 52.5 mt -59.63 -58.7 5.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 114.812 -1.086 . . . . 71.14 109.44 178.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.0 t -56.5 -35.6 68.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.153 0.581 . . . . 74.32 111.693 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -57.38 -58.32 8.78 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.426 1.09 . . . . 74.1 111.621 178.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.402 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 1.7 p90 -75.47 -34.7 60.93 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.779 -0.452 . . . . 72.44 109.779 -177.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.509 HD22 HE22 ' A' ' 149' ' ' GLN . 12.7 tp -66.32 -37.94 86.52 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.65 1.18 . . . . 75.25 111.503 -168.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -66.67 -19.43 65.76 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.86 -0.609 . . . . 74.5 111.221 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.94 -23.0 14.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.101 0.96 . . . . 70.45 111.423 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.729 ' HB3' ' HB3' ' A' ' 95' ' ' LYS . 74.4 m -96.89 106.4 18.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.368 1.067 . . . . 72.11 110.721 -174.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -86.45 -45.25 11.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.603 0.761 . . . . 75.12 111.681 -173.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -124.5 -3.34 7.87 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.92 0.888 . . . . 74.51 111.105 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.729 ' HB3' ' HB3' ' A' ' 92' ' ' SER . 47.3 tptt -70.05 93.58 0.81 Allowed 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.694 -1.224 . . . . 74.25 107.694 170.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.536 HD12 ' HB2' ' A' ' 141' ' ' ALA . 14.1 mm -62.75 155.28 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 114.961 -1.018 . . . . 72.4 108.826 178.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.402 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 2.0 tp -50.54 -43.71 56.2 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.632 0.729 . . . . 75.34 111.582 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.531 ' CZ ' HG22 ' A' ' 76' ' ' ILE . 3.5 m-85 -118.05 25.09 10.58 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 114.421 -1.263 . . . . 71.03 110.797 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -40.34 -56.95 1.87 Allowed 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 124.535 1.134 . . . . 75.51 112.559 -167.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.96 -55.32 8.59 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.184 0.993 . . . . 74.31 111.074 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.4 -46.1 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 124.29 1.036 . . . . 71.11 111.954 -174.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -76.38 -28.73 56.87 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.983 1.313 . . . . 73.22 110.407 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -62.48 -39.4 93.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 109.85 -0.426 . . . . 73.22 109.85 168.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.446 ' HZ3' ' HB3' ' A' ' 104' ' ' LYS . 8.4 mtpm? -68.39 -36.94 79.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.38 0.672 . . . . 75.25 110.464 175.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.84 -39.15 90.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.854 0.461 . . . . 72.01 110.777 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 66.1 m -72.6 -41.06 66.02 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.368 0.667 . . . . 71.13 111.209 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.491 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 15.9 t70 -80.1 -36.3 35.63 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.748 0.419 . . . . 75.21 110.599 -176.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.473 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.2 t -69.85 -28.78 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 110.084 -0.339 . . . . 75.45 110.084 172.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -69.43 -34.84 75.03 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 119.333 -0.365 . . . . 70.52 110.703 170.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.491 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 51.8 mtpt -57.22 -57.61 11.85 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 109.616 -0.513 . . . . 75.35 109.616 171.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.2 mt-10 -51.72 -47.18 64.09 Favored 'General case' 0 C--N 1.358 0.94 0 O-C-N 124.447 1.092 . . . . 72.55 110.415 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -64.08 -60.46 3.21 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 124.176 0.99 . . . . 74.12 109.965 -173.057 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -53.27 -38.94 63.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.065 0.946 . . . . 63.52 111.513 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.429 ' O ' HG21 ' A' ' 118' ' ' VAL . 96.6 mt -60.2 -62.78 1.61 Allowed 'General case' 0 CA--C 1.545 0.777 0 O-C-N 123.703 0.627 . . . . 75.14 111.149 175.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.622 HD12 HD13 ' A' ' 58' ' ' LEU . 2.5 pp -65.9 -23.15 66.58 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.724 0.639 . . . . 72.23 112.724 -176.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.418 HD12 ' SD ' ' A' ' 122' ' ' MET . 80.8 mt -72.86 -42.28 63.84 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 123.483 0.713 . . . . 74.52 110.001 175.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -75.77 -26.01 56.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.506 0.322 . . . . 74.22 111.402 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 114' ' ' LEU . 77.8 t -75.25 -61.81 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.695 -0.483 . . . . 74.3 109.695 177.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -59.02 2.37 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.977 0.511 . . . . 75.31 110.066 -170.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.576 HE21 ' HG3' ' A' ' 51' ' ' ARG . 27.8 mp0 -76.85 -14.09 59.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.241 0.616 . . . . 74.4 111.569 -174.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 63.65 22.84 13.3 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 124.884 1.274 . . . . 75.44 111.04 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.528 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 48.6 ttm -55.45 115.41 9.24 Favored Pre-proline 0 C--N 1.357 0.894 0 C-N-CA 124.654 1.182 . . . . 71.54 111.999 -173.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.47 91.98 1.16 Allowed 'Trans proline' 0 C--N 1.367 1.502 0 C-N-CA 122.108 1.872 . . . . 75.21 109.72 172.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 m -67.04 88.03 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 CA-C-O 122.32 1.057 . . . . 74.24 109.954 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 37.1 m -97.05 -48.35 0.23 Allowed Pre-proline 0 CA--C 1.563 1.467 0 CA-C-N 114.313 -1.312 . . . . 74.01 112.21 -176.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.36 -12.68 34.21 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.823 1.682 . . . . 74.1 112.998 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 14.9 tt -148.84 155.67 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.929 0.892 . . . . 64.42 109.061 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.1 t -104.35 -165.91 1.19 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.442 0.697 . . . . 63.43 109.638 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -57.81 -40.5 80.12 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.899 0.88 . . . . 73.34 111.88 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 120.44 37.63 0.72 Allowed Glycine 0 C--N 1.345 1.033 0 CA-C-N 115.963 -0.562 . . . . 75.03 112.275 -177.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.67 87.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.327 0.651 . . . . 71.3 109.501 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 35.7 t -60.01 -35.96 76.18 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 114.782 -1.099 . . . . 71.05 110.913 173.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 11.3 m0 -68.52 -17.26 64.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.428 1.091 . . . . 75.31 113.286 -171.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.52 -40.76 18.76 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.781 -0.574 . . . . 73.44 110.721 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -73.35 -39.05 65.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.989 -1.005 . . . . 74.35 111.481 -171.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.417 ' O ' ' HB2' ' A' ' 140' ' ' ASP . 41.7 mt-10 -52.59 -56.82 12.63 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 124.917 1.287 . . . . 75.14 111.068 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.508 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 3.5 m-20 -63.5 -57.64 9.57 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.031 -0.986 . . . . 74.1 112.368 -172.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -59.23 -58.89 6.66 Favored 'General case' 0 CA--C 1.561 1.404 0 O-C-N 123.062 0.226 . . . . 75.51 111.406 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.82 -56.19 6.87 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 122.36 0.264 . . . . 74.2 110.63 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 136' ' ' GLU . 5.5 m-20 -74.99 -28.84 60.7 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.299 -0.858 . . . . 71.43 112.254 -170.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.536 ' HB2' HD12 ' A' ' 96' ' ' ILE . . . -78.89 -24.44 44.2 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.655 1.116 . . . . 74.13 110.967 176.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -65.84 -47.03 76.37 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 109.745 -0.465 . . . . 75.14 109.745 167.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.69 -39.66 77.66 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.952 0.901 . . . . 74.32 110.781 175.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.588 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 29.8 t0 -75.02 -42.93 56.32 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.198 0.999 . . . . 71.1 111.906 -172.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 61.6 ttt-85 -64.7 -41.7 95.83 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.1 -0.954 . . . . 71.14 109.719 178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -65.09 -34.9 79.51 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.186 -0.915 . . . . 74.43 110.806 172.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.56 -19.56 59.22 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.855 0.462 . . . . 73.52 111.491 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.63 -58.79 3.06 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.866 -0.79 . . . . 64.21 108.866 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . 0.509 HE22 HD22 ' A' ' 89' ' ' LEU . 1.9 mp0 -70.14 -46.72 64.13 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.587 0.755 . . . . 75.42 111.494 -175.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 75.3 mtp -96.86 36.25 1.43 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.572 0.749 . . . . 74.33 110.397 -178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.7 111.87 2.27 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.703 0.801 . . . . 75.53 110.702 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -99.29 16.67 22.21 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.065 0.546 . . . . 64.23 110.763 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.07 105.62 11.19 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.802 -0.814 . . . . 75.32 108.802 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 65.17 13.67 8.89 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.975 1.31 . . . . 74.04 113.147 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -99.88 148.22 24.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.874 0.869 . . . . 71.4 109.233 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 . . . . . 0 CA--C 1.557 1.241 0 C-N-CA 124.804 1.241 . . . . 71.33 110.845 -178.206 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.597 0.237 . . . . 75.1 110.566 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.23 -52.79 9.3 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.079 0.551 . . . . 75.14 110.553 178.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -61.07 -41.01 95.83 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.885 0.74 . . . . 71.54 109.484 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.428 HD13 HD11 ' A' ' 42' ' ' LEU . 3.6 mm? -58.17 -52.11 66.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.303 0.641 . . . . 75.34 110.409 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -53.85 -38.67 64.91 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.135 0.574 . . . . 73.34 111.083 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.424 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.5 t-80 -65.88 -49.5 67.85 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 123.805 0.691 . . . . 75.3 110.49 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.96 -52.58 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 124.876 1.27 . . . . 74.03 111.477 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 1.7 mp -64.71 -40.87 90.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.035 0.934 . . . . 70.34 110.693 -177.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 55.3 m -62.75 -42.5 99.71 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.693 0.397 . . . . 75.34 110.75 176.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 79.6 mt -57.4 -56.65 19.09 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.37 0.419 . . . . 72.14 110.084 177.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.58 -35.7 92.18 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 124.279 0.987 . . . . 72.31 113.827 -176.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.429 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 4.5 tp-100 -70.38 -49.5 48.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 109.636 -0.505 . . . . 74.13 109.636 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.99 -33.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.564 0.746 . . . . 72.02 110.774 175.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 23.1 mt -54.61 -55.96 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.949 0.9 . . . . 65.15 109.768 173.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -60.39 -38.7 84.79 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 124.155 0.909 . . . . 73.2 111.686 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.429 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 13.5 mptt -60.84 -54.64 42.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.008 0.923 . . . . 72.32 111.918 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -79.48 -19.22 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.461 0.704 . . . . 65.31 111.989 -175.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.6 t -64.33 -17.81 64.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.365 1.066 . . . . 75.41 113.068 177.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -55.42 -20.63 12.82 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 123.961 0.905 . . . . 72.31 112.915 175.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -62.8 -29.87 71.04 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.408 0.683 . . . . 73.31 112.472 175.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.433 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 8.3 mmt -78.45 81.83 4.76 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.101 0.477 . . . . 65.04 110.679 -173.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -80.55 -34.51 35.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.139 -1.06 . . . . 75.21 108.139 169.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.441 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 85.7 m-85 -90.81 153.32 20.32 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 114.186 -1.37 . . . . 71.52 108.217 170.099 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m 57.81 70.99 0.61 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.369 1.08 . . . . 53.53 109.536 -166.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.416 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 0.1 OUTLIER -75.08 -48.69 22.65 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 113.803 -1.544 . . . . 73.55 109.411 -170.559 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.0 mptp? -61.68 -37.37 83.84 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 109.416 -0.587 . . . . 75.21 109.416 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.763 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 16.0 mm-40 -66.25 -43.85 85.37 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 117.862 0.301 . . . . 70.11 111.16 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 52.7 t -66.78 -43.02 85.08 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.906 0.882 . . . . 73.12 111.874 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.416 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.3 mpt_? -80.93 -33.55 33.97 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.557 0.743 . . . . 74.4 111.033 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.504 ' NH2' ' HB2' ' A' ' 136' ' ' GLU . 25.6 tpt180 -73.16 -38.63 66.15 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.185 -0.672 . . . . 64.33 109.185 176.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.73 -46.33 90.11 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 123.815 0.697 . . . . 74.12 109.159 173.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.2 -46.22 93.07 Favored Glycine 0 C--N 1.349 1.298 0 O-C-N 123.879 0.737 . . . . 71.12 112.63 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -60.46 -52.82 63.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.453 0.701 . . . . 74.54 110.452 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.52 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 16.3 mtt180 -58.81 -63.4 1.31 Allowed 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.094 0.871 . . . . 73.21 110.547 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.423 ' O ' HG12 ' A' ' 39' ' ' ILE . 55.8 t -50.93 -50.57 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.305 1.042 . . . . 73.04 111.942 -175.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -62.46 -41.54 98.83 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 123.369 0.418 . . . . 71.25 111.188 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.55 -23.55 72.12 Favored Glycine 0 N--CA 1.474 1.17 0 CA-C-N 116.325 -0.398 . . . . 61.5 113.34 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.559 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 27.6 mt -87.2 -46.98 9.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 74.32 111.301 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 35' ' ' VAL . 23.0 pt -80.47 -41.55 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 117.933 -1.032 . . . . 70.41 111.917 -170.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -54.77 -48.27 95.97 Favored Pre-proline 0 N--CA 1.497 1.891 0 N-CA-C 113.724 1.009 . . . . 75.43 113.724 -174.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.66 ' HA ' ' HE2' ' A' ' 44' ' ' MET . 55.9 Cg_exo -54.76 -39.36 89.94 Favored 'Trans proline' 0 C--N 1.391 2.785 0 C-N-CA 122.1 1.866 . . . . 74.23 112.868 175.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.481 HD13 HD22 ' A' ' 45' ' ' LEU . 4.2 mm? -77.08 -29.39 54.97 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.224 -0.898 . . . . 75.21 111.359 178.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -67.22 -38.14 84.76 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.323 0.649 . . . . 72.2 109.973 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.66 ' HE2' ' HA ' ' A' ' 41' ' ' PRO . 67.3 mtm -62.07 -50.77 70.65 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.779 0.675 . . . . 75.02 111.019 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.481 HD22 HD13 ' A' ' 42' ' ' LEU . 4.4 pp -76.51 -22.77 54.0 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.698 0.399 . . . . 65.33 111.967 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -71.24 -41.15 70.51 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.608 0.763 . . . . 72.45 110.211 174.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -73.17 -43.73 61.02 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.909 0.884 . . . . 75.42 108.882 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -61.02 -47.71 85.17 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.028 1.331 . . . . 71.45 110.096 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 54.3 38.11 61.23 Favored Glycine 0 C--N 1.35 1.326 0 O-C-N 124.881 1.363 . . . . 73.4 115.069 173.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -86.95 77.65 9.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 122.659 0.384 . . . . 73.32 110.512 -175.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 45.04 70.44 0.35 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.607 1.563 . . . . 75.14 113.017 169.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -87.58 126.28 34.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.937 0.495 . . . . 75.42 110.21 -176.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.3 t -80.64 118.42 72.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 123.493 0.717 . . . . 75.55 109.361 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -78.2 165.84 25.3 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.492 2.128 . . . . 73.34 111.774 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.1 t -150.08 153.96 37.31 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.12 -1.066 . . . . 61.33 108.12 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -62.74 -44.73 95.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 122.495 0.318 . . . . 74.44 110.875 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.535 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.86 -37.28 76.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.388 0.675 . . . . 64.41 111.147 175.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.45 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 2.8 tm? -70.94 -47.66 57.77 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 124.11 0.964 . . . . 73.45 109.392 -175.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.3 m -64.46 -40.57 95.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.08 0.862 . . . . 74.41 110.857 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.8 m -58.52 -49.11 78.58 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.788 0.835 . . . . 73.15 110.756 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.09 98.64 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.722 0.809 . . . . 73.44 111.0 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.501 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.6 mmt -67.84 -33.62 75.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.668 0.787 . . . . 74.44 111.14 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -73.27 -35.88 66.26 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.544 0.737 . . . . 64.35 110.751 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.278 0.631 . . . . 61.43 110.112 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.559 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 2.5 t80 -67.17 -45.91 75.56 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.116 1.366 . . . . 70.11 109.507 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.2 ttpp -58.32 -51.29 70.4 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.812 -1.54 . . . . 73.22 110.009 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.72 -43.2 76.3 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.177 0.923 . . . . 75.11 111.392 -178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.504 ' HB3' HD12 ' A' ' 105' ' ' LEU . . . -61.8 -42.63 99.26 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 114.984 -1.007 . . . . 74.51 111.639 177.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -74.41 -25.8 59.68 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.931 0.492 . . . . 73.33 112.3 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.498 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 62.1 mt-10 -67.11 -44.04 80.95 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.619 0.724 . . . . 73.35 109.341 174.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.1 mt-10 -67.53 -43.18 81.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.509 -1.223 . . . . 75.54 111.01 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.57 -40.26 96.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.466 0.707 . . . . 62.2 111.23 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.42 -43.43 98.88 Favored 'General case' 0 C--N 1.351 0.64 0 O-C-N 124.235 0.959 . . . . 75.21 109.758 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.2 -33.34 86.98 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.555 -0.748 . . . . 62.34 113.89 175.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 26.0 mm-40 -63.69 -57.94 8.45 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.998 -0.371 . . . . 73.14 109.998 178.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.56 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -66.7 -20.13 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.62 0.6 . . . . 74.3 112.62 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.74 -49.56 75.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.104 -0.702 . . . . 72.23 109.104 171.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -80.83 -25.97 37.36 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 111.811 0.3 . . . . 74.14 111.811 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.56 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.7 m-30 -77.81 -5.21 50.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.595 0.758 . . . . 74.32 112.131 -178.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.8 p -55.91 -30.71 62.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.244 0.617 . . . . 74.42 110.178 173.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -81.76 107.55 14.58 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 108.657 -0.868 . . . . 73.51 108.657 167.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -68.26 -25.82 65.36 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.345 0.658 . . . . 75.54 110.749 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.7 p -71.23 -33.02 69.47 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 75.2 111.336 175.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.95 -40.57 98.08 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.566 0.746 . . . . 65.23 110.047 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.577 HG22 HD11 ' A' ' 97' ' ' LEU . 32.3 mt -57.87 -61.25 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.846 0 CA-C-N 114.83 -1.077 . . . . 73.23 109.911 175.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.99 -40.57 61.15 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.976 0.91 . . . . 72.24 111.971 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 47.3 tpt85 -58.92 -56.68 19.11 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.449 -1.25 . . . . 74.32 111.754 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -21.27 51.66 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 110.219 -0.289 . . . . 72.11 110.219 -177.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.489 HD22 HE22 ' A' ' 149' ' ' GLN . 17.3 tp -73.3 -40.81 64.24 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.932 0.893 . . . . 72.01 110.576 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -67.11 -23.92 65.88 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.026 0.441 . . . . 54.12 110.607 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.33 -0.26 41.5 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.591 1.156 . . . . 72.11 111.8 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.6 t -66.55 131.05 45.18 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.279 0.632 . . . . 54.01 110.369 -176.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -81.78 -7.8 59.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.763 0.825 . . . . 74.01 111.294 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.36 -175.46 4.0 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.706 0.802 . . . . 52.05 110.158 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 -45.96 10.22 Favored 'General case' 0 C--O 1.242 0.689 0 C-N-CA 123.763 0.825 . . . . 72.11 110.909 178.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.657 HD12 ' HG2' ' A' ' 99' ' ' LYS . 3.1 mp -76.3 131.59 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 123.759 0.662 . . . . 74.33 109.825 -168.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.763 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.9 tp -62.97 -39.75 95.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.237 1.015 . . . . 74.34 111.096 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -103.56 17.74 23.42 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 114.354 -1.294 . . . . 72.42 111.016 -175.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.657 ' HG2' HD12 ' A' ' 96' ' ' ILE . 2.1 tmtp? -35.45 -64.27 0.3 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 124.78 1.232 . . . . 74.52 113.571 -157.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.446 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 25.8 t70 -61.82 -48.84 78.77 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 124.044 0.84 . . . . 70.34 110.797 -175.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.19 -44.95 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.85 . . . . 74.32 111.268 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -75.43 -25.93 57.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.599 0.76 . . . . 72.12 110.221 -175.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.65 -38.64 89.91 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.827 -0.805 . . . . 74.43 108.827 170.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.446 ' HD3' ' O ' ' A' ' 100' ' ' ASP . 1.4 mptm? -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 118.855 -0.593 . . . . 72.04 110.846 172.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.504 HD12 ' HB3' ' A' ' 68' ' ' ALA . 10.5 mp -58.12 -43.76 87.38 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 119.275 0.943 . . . . 75.22 110.389 172.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.52 ' HB2' HH12 ' A' ' 34' ' ' ARG . 9.5 t -67.33 -51.62 50.16 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.421 0.688 . . . . 70.52 111.256 -175.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 14.0 t70 -69.26 -50.02 50.81 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.531 -1.213 . . . . 73.02 110.11 -174.174 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.56 -35.95 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 118.944 -0.55 . . . . 75.03 110.806 -178.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.538 ' HH2' HG13 ' A' ' 124' ' ' VAL . 45.5 t-105 -60.6 -48.52 81.39 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 118.373 0.533 . . . . 75.01 110.567 176.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.42 -37.08 84.41 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 118.931 -0.557 . . . . 75.45 110.961 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.5 mm-40 -61.42 -48.23 82.15 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.265 0.484 . . . . 52.24 111.398 175.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.501 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.0 tt -64.79 -51.93 59.55 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.294 1.438 . . . . 75.42 109.733 -175.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.9 t -60.78 -42.24 97.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.802 1.241 . . . . 71.23 111.538 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.2 -55.88 27.1 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 119.342 -0.361 . . . . 75.21 110.86 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.535 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 4.5 pp -61.53 -29.82 70.24 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.579 0.228 . . . . 71.1 111.571 -177.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.547 HD22 ' SD ' ' A' ' 122' ' ' MET . 58.9 mt -62.42 -53.63 52.01 Favored 'General case' 0 C--N 1.359 0.99 0 CA-C-N 115.813 -0.63 . . . . 71.53 111.126 171.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -68.88 -35.1 76.48 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.979 0.512 . . . . 73.41 111.839 -175.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.61 -58.68 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.183 0.593 . . . . 72.0 110.512 -177.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -97.05 -56.42 2.56 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.354 0.502 . . . . 64.34 112.354 -171.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -71.46 -14.87 62.27 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 112.128 0.418 . . . . 73.44 112.128 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 60.53 23.53 13.22 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.842 1.257 . . . . 75.15 111.975 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.547 ' SD ' HD22 ' A' ' 116' ' ' LEU . 64.4 mtp -79.96 118.26 71.52 Favored Pre-proline 0 C--N 1.351 0.666 0 C-N-CA 124.408 1.083 . . . . 75.1 109.552 179.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -84.7 48.68 2.45 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 123.148 2.565 . . . . 71.31 111.882 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.538 HG13 ' HH2' ' A' ' 109' ' ' TRP . 51.5 t -91.32 80.33 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.346 0.429 0 C-N-CA 124.213 1.005 . . . . 74.23 109.514 -174.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 21.2 t -166.06 84.6 0.97 Allowed Pre-proline 0 C--O 1.242 0.709 0 CA-C-N 114.735 -1.12 . . . . 70.44 108.383 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -79.03 35.8 0.58 Allowed 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 123.103 2.535 . . . . 63.0 112.214 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 8.4 tt -157.54 -52.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 123.973 0.909 . . . . 75.23 110.472 -172.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.9 t 57.99 -148.79 0.47 Allowed 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.014 0.926 . . . . 75.54 109.536 -172.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.53 -89.28 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.968 0.907 . . . . 72.52 110.672 170.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 75.93 -26.3 1.45 Allowed Glycine 0 CA--C 1.545 1.916 0 N-CA-C 116.169 1.228 . . . . 73.24 116.169 170.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -81.59 -58.02 3.2 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.318 1.059 . . . . 70.53 111.62 -172.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 61.0 m -75.18 -12.68 60.35 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.425 0.69 . . . . 74.1 110.924 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.449 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 11.0 t90 -51.01 -54.77 21.61 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.955 1.302 . . . . 65.22 110.888 177.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.23 -20.63 65.71 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.793 0.837 . . . . 73.44 112.145 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.423 ' O ' ' HG2' ' A' ' 138' ' ' GLN . 67.3 mt-30 -77.68 -34.23 53.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.32 0.648 . . . . 72.24 110.27 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.504 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . 45.2 mt-10 -64.88 -42.19 95.01 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 109.236 -0.653 . . . . 73.44 109.236 173.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -56.52 -44.72 81.07 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.886 0.741 . . . . 74.14 111.836 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 2.5 pt20 -76.17 -30.7 58.19 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.387 0.429 . . . . 65.23 111.58 -176.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -65.63 -53.05 46.88 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.654 0.782 . . . . 74.42 110.253 174.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.8 -46.88 77.91 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 114.534 -1.212 . . . . 71.35 111.221 175.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.407 ' HA ' ' NE2' ' A' ' 27' ' ' GLN . . . -68.2 -29.26 68.07 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.821 0.849 . . . . 53.13 112.808 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.36 -49.62 66.29 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.157 0.503 . . . . 64.21 109.988 175.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.7 -31.69 73.03 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.382 -1.281 . . . . 74.24 111.605 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.7 t0 -79.55 -41.44 27.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.058 0.943 . . . . 71.33 111.509 -175.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.4 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 53.8 ttt180 -66.6 -37.16 84.32 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.731 . . . . 64.24 109.629 176.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -68.7 -35.64 77.45 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.317 -0.856 . . . . 74.42 110.829 171.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -23.96 61.31 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.664 0.386 . . . . 63.14 111.172 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.441 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.3 OUTLIER -79.7 -60.82 2.2 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.31 0.644 . . . . 73.32 110.011 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . 0.489 HE22 HD22 ' A' ' 89' ' ' LEU . 2.0 mp0 -71.03 -45.35 64.06 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.841 0.456 . . . . 73.21 111.186 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ttm -99.88 60.38 1.09 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.016 -1.105 . . . . 60.31 108.016 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 30.9 tp -81.74 89.68 6.3 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.17 0.986 . . . . 72.22 109.311 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.84 25.97 5.58 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 113.564 -1.653 . . . . 75.12 108.767 176.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.56 ' HG2' ' H ' ' A' ' 154' ' ' ASP . 56.2 ttt180 -119.36 -163.65 1.0 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 107.211 -1.403 . . . . 75.24 107.211 -177.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.56 ' H ' ' HG2' ' A' ' 153' ' ' ARG . 45.2 m-20 -54.9 105.82 0.18 Allowed 'General case' 0 C--N 1.356 0.869 0 CA-C-N 118.536 0.607 . . . . 74.21 109.931 166.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -77.5 -15.47 59.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.694 -0.685 . . . . 74.42 110.448 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--O 1.253 1.273 0 CA-C-O 118.714 -0.66 . . . . 75.32 110.419 178.111 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.522 ' SD ' ' HA ' ' A' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.376 0.131 . . . . 73.21 111.169 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -62.89 -28.9 70.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.898 0.879 . . . . 75.53 111.669 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.21 -45.22 61.82 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.465 0.706 . . . . 73.13 110.314 172.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.416 ' O ' HD11 ' A' ' 8' ' ' ILE . 4.0 mm? -65.06 -41.56 95.01 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 115.153 -0.93 . . . . 74.22 110.675 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -57.82 -46.55 84.54 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 109.605 -0.517 . . . . 74.52 109.605 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -60.79 -55.46 32.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.757 0.66 . . . . 71.12 110.859 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.7 mt -57.42 -53.95 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.724 0.809 . . . . 75.41 112.167 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.482 HD13 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -61.07 -44.34 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.301 1.04 . . . . 75.43 110.511 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 95.9 m -63.73 -46.38 85.64 Favored 'General case' 0 C--N 1.358 0.952 0 C-N-CA 122.88 0.472 . . . . 74.21 111.262 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.8 -46.28 87.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.466 0.706 . . . . 62.32 110.936 -178.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.418 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.2 -49.93 71.1 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 124.608 1.193 . . . . 75.03 111.966 178.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -56.09 -46.72 78.95 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.962 0.505 . . . . 70.3 111.365 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.2 -38.32 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.789 0.836 . . . . 73.3 111.15 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.25 -53.59 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.771 0.828 . . . . 70.24 110.197 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -60.73 -33.05 72.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.848 0.859 . . . . 74.54 111.43 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -75.22 -53.17 9.25 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.293 0.637 . . . . 72.31 111.186 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.487 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 12.1 ptm180 -66.93 -30.44 70.58 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 111.753 0.279 . . . . 73.21 111.753 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.636 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.1 t -59.76 -17.89 38.93 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.861 1.264 . . . . 64.43 112.995 -175.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -53.32 -23.57 9.59 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.602 0.761 . . . . 60.34 112.332 173.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.72 -13.28 61.97 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.197 0.999 . . . . 71.54 112.066 -178.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.1 mmt -76.3 96.35 3.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.514 -0.551 . . . . 75.34 109.514 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -29.42 39.35 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.456 -0.942 . . . . 75.2 108.456 174.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.405 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 43.6 m-85 -99.97 175.99 5.58 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.439 1.096 . . . . 75.11 110.194 169.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.484 ' SG ' HG23 ' A' ' 85' ' ' ILE . 70.9 m 53.67 79.5 0.13 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.385 1.053 . . . . 74.14 110.138 -171.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -73.86 -61.21 1.93 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.551 -0.749 . . . . 75.25 109.591 -170.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 48.8 mttm -67.15 -39.52 86.55 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 114.416 -1.266 . . . . 74.3 111.781 -174.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.442 ' HG2' HH22 ' A' ' 30' ' ' ARG . 45.7 mt-30 -71.22 -31.45 67.6 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.07 0.548 . . . . 60.44 111.84 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.636 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 53.2 t -76.63 -40.79 48.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.315 0.646 . . . . 54.33 110.692 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 mtp-105 -65.39 -38.35 89.72 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.219 0.608 . . . . 74.24 110.657 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.611 HH22 ' HB3' ' A' ' 141' ' ' ALA . 6.5 mtp180 -66.44 -44.42 82.92 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.175 -0.917 . . . . 73.2 109.939 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.566 HD22 ' SG ' ' A' ' 18' ' ' CYS . 55.5 tp -56.08 -49.29 74.22 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.71 0.631 . . . . 72.34 110.776 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.36 -45.87 92.42 Favored Glycine 0 C--N 1.351 1.388 0 O-C-N 123.989 0.806 . . . . 53.5 112.166 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -60.93 -42.55 98.4 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.309 1.043 . . . . 74.52 111.49 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 57.1 mtt180 -59.22 -61.04 2.93 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.7 -0.852 . . . . 75.4 108.7 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.3 t -51.09 -49.04 29.74 Favored 'Isoleucine or valine' 0 C--N 1.353 0.75 0 O-C-N 125.47 1.731 . . . . 73.22 111.636 -175.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 97.1 mt -61.12 -43.61 98.62 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 124.097 0.873 . . . . 70.2 111.063 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.88 -25.59 74.18 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.553 0.533 . . . . 52.24 113.354 176.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.511 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 20.0 mt -82.89 -43.12 16.93 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.204 0.602 . . . . 72.14 111.127 -177.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.418 HG21 ' HA3' ' A' ' 11' ' ' GLY . 12.1 pt -79.07 -30.98 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.43 -0.795 . . . . 74.15 110.544 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.532 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 57.2 tptt -43.07 -59.45 3.11 Favored Pre-proline 0 N--CA 1.494 1.772 0 C-N-CA 124.346 1.058 . . . . 74.4 113.127 -178.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 26.0 Cg_exo -65.8 -31.62 47.98 Favored 'Trans proline' 0 C--N 1.392 2.835 0 C-N-CA 122.133 1.888 . . . . 75.44 112.609 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.482 ' HB3' HD13 ' A' ' 8' ' ' ILE . 3.4 mm? -79.44 -25.06 42.06 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.415 0.686 . . . . 74.12 110.768 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -73.01 -36.3 66.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.345 0.658 . . . . 74.14 109.324 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.428 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.7 mmt -63.79 -24.55 67.8 Favored 'General case' 0 N--CA 1.482 1.139 0 O-C-N 123.74 0.65 . . . . 70.44 110.529 175.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 77.2 mt -73.83 -64.01 1.09 Allowed 'General case' 0 C--N 1.355 0.814 0 N-CA-C 109.276 -0.639 . . . . 75.31 109.276 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -54.71 -34.65 62.71 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.182 0.808 . . . . 73.1 113.182 -167.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -73.39 -67.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.403 0.281 . . . . 74.44 111.7 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.36 -59.11 2.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 120.69 0.281 . . . . 73.22 111.023 -174.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.34 63.69 4.12 Favored Glycine 0 C--N 1.344 0.977 0 CA-C-N 115.842 -0.617 . . . . 74.13 111.832 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.542 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 5.0 ttmp? -88.05 152.92 21.68 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 108.927 -0.768 . . . . 74.32 108.927 176.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 68.62 20.28 8.34 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 124.641 1.176 . . . . 73.41 111.444 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.447 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 46.7 m -66.04 144.65 56.59 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.328 -0.619 . . . . 62.24 109.328 171.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 41.5 t -98.08 102.04 12.73 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.566 0.747 . . . . 71.13 109.082 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.447 ' HD3' ' O ' ' A' ' 52' ' ' SER . 8.2 Cg_exo -73.71 130.02 14.23 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.568 2.179 . . . . 72.12 109.993 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 69.8 p -63.85 171.28 2.86 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.24 0.616 . . . . 52.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -58.85 -45.17 90.71 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.978 0.511 . . . . 74.43 111.126 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -70.79 -34.68 72.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.279 0.631 . . . . 75.44 111.867 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.558 HD22 HD12 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -59.82 -49.26 78.42 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.182 -1.044 . . . . 73.14 108.182 176.681 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -64.98 -35.18 80.36 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.482 1.113 . . . . 74.42 111.014 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.2 m -59.33 -48.26 82.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.845 0.458 . . . . 73.34 110.54 176.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.98 -40.6 94.07 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.833 0.708 . . . . 73.21 110.98 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.54 ' HE3' ' HA ' ' A' ' 62' ' ' MET . 14.3 mmt -61.97 -41.36 97.91 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.542 0.737 . . . . 73.21 111.836 178.054 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -69.78 -39.1 76.83 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.444 0.698 . . . . 72.23 110.719 -178.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -65.76 -37.96 87.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.408 0.683 . . . . 75.22 110.884 176.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.511 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 1.7 t80 -70.05 -43.49 71.14 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.882 0.739 . . . . 73.22 109.969 -177.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -58.99 -50.26 74.76 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.669 1.188 . . . . 70.24 110.825 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.91 -41.42 97.9 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 124.019 0.824 . . . . 72.14 111.241 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.88 -38.88 92.73 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.88 0.737 . . . . 72.14 111.169 179.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.68 -43.71 92.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.084 0.554 . . . . 74.43 110.886 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.72 -34.02 76.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.451 0.701 . . . . 62.54 111.095 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 36.9 mm-40 -69.3 -42.93 74.78 Favored 'General case' 0 C--N 1.351 0.634 0 O-C-N 123.603 0.564 . . . . 73.13 111.349 175.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.48 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.066 0.546 . . . . 61.12 111.173 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -60.36 -44.54 95.49 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.17 0.988 . . . . 61.32 109.641 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -62.11 -36.73 93.37 Favored Glycine 0 C--N 1.347 1.183 0 O-C-N 124.239 0.962 . . . . 74.0 112.916 176.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 18.2 mm-40 -62.75 -56.93 13.13 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 117.273 0.536 . . . . 65.13 110.16 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.438 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.9 pt -65.56 -18.98 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 112.169 0.433 . . . . 64.35 112.169 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.487 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 27.2 tt0 -70.91 -39.91 72.45 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 122.691 0.396 . . . . 74.54 110.653 173.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 48.9 mttm -74.98 -30.23 61.12 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.899 0.381 . . . . 73.2 110.467 175.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.438 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.0 m-85 -81.36 0.03 39.12 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.662 0.785 . . . . 71.44 112.228 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.6 p -55.75 -34.79 65.52 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.82 0.819 . . . . 74.33 110.955 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.477 ' HB2' ' ND2' ' A' ' 84' ' ' ASN . 21.6 m-80 -93.67 113.5 25.6 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.164 -1.421 . . . . 73.2 107.164 168.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -69.76 -21.53 63.43 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.941 0.896 . . . . 74.52 110.843 -171.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.3 m -63.13 -33.46 75.5 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.917 0.887 . . . . 72.21 111.691 173.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.477 ' ND2' ' HB2' ' A' ' 81' ' ' ASN . 88.3 m-20 -67.09 -38.3 85.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.264 0.626 . . . . 73.41 110.228 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.578 HG21 HD13 ' A' ' 97' ' ' LEU . 52.2 mt -55.72 -60.86 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.967 0 O-C-N 124.082 0.864 . . . . 74.54 109.197 172.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 52.7 t -53.82 -37.78 63.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.08 0.952 . . . . 73.33 111.63 -177.778 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -58.78 -57.54 12.58 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.429 1.08 . . . . 71.23 111.033 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.51 -28.2 56.31 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 110.366 -0.235 . . . . 75.34 110.366 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -68.43 -39.7 81.43 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.454 1.102 . . . . 75.42 110.934 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.9 t -65.26 -31.25 72.31 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.626 0.579 . . . . 74.53 110.956 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.23 -1.26 31.58 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.833 0.853 . . . . 74.23 111.64 -177.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 t -70.38 131.08 43.57 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.493 0.717 . . . . 70.43 111.139 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.25 -9.99 26.62 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.425 0.69 . . . . 65.14 109.764 168.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -71.44 -52.63 17.47 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.563 0.745 . . . . 63.4 109.611 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.577 ' HD2' ' HA ' ' A' ' 142' ' ' ASP . 37.4 ttpt 80.31 -39.81 0.18 Allowed 'General case' 0 C--N 1.363 1.186 0 O-C-N 125.73 1.893 . . . . 75.13 111.684 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.614 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 4.2 mp -73.42 132.93 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 107.696 -1.224 . . . . 74.41 107.696 165.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.578 HD13 HG21 ' A' ' 85' ' ' ILE . 10.9 tp -62.97 -29.6 70.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.062 0.945 . . . . 74.14 112.734 -172.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -120.33 8.63 10.85 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 117.999 -1.001 . . . . 71.45 111.211 -174.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.614 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 28.2 ttpt -35.68 -59.59 0.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 114.724 1.379 . . . . 74.53 114.724 -156.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 31.3 t70 -66.89 -42.98 84.61 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.63 0.772 . . . . 64.14 111.563 -175.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.59 -38.02 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.242 0.617 . . . . 65.32 110.179 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -80.27 -18.16 50.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.42 0.688 . . . . 70.53 110.233 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -73.68 -34.0 64.69 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.505 -0.924 . . . . 75.02 108.505 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 48.3 mttm -62.9 -46.47 87.68 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.482 -0.562 . . . . 72.14 109.482 170.01 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -56.23 -43.29 78.47 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 123.336 0.397 . . . . 64.55 110.902 173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t -70.46 -34.95 73.01 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.332 0.653 . . . . 61.44 111.332 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.428 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 18.0 t70 -72.27 -55.53 7.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.982 0.913 . . . . 72.41 109.496 -176.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.87 -53.76 38.33 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 114.907 -1.042 . . . . 75.44 109.598 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -61.5 -37.97 85.61 Favored 'General case' 0 C--N 1.357 0.93 0 CA-C-O 118.364 -0.827 . . . . 75.2 112.831 -175.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.7 ptmt -65.39 -47.64 75.65 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.556 1.071 . . . . 74.32 108.921 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.03 -35.59 80.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 120.93 0.395 . . . . 74.51 110.899 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.422 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 7.3 tt -72.82 -44.42 61.5 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.803 1.241 . . . . 73.35 110.023 -173.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.449 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 31.1 t -67.4 -40.93 85.66 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.349 0.66 . . . . 74.12 109.444 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 92.5 mt -64.13 -39.74 94.68 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 123.504 0.502 . . . . 73.43 112.019 178.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.558 HD12 HD22 ' A' ' 58' ' ' LEU . 4.2 pp -73.88 -25.25 59.93 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.064 0.393 . . . . 71.13 110.515 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.57 HD12 ' SD ' ' A' ' 122' ' ' MET . 89.8 mt -69.67 -32.01 70.4 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 119.61 -0.233 . . . . 72.12 110.393 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 113' ' ' SER . 24.0 mm-40 -67.21 -52.35 42.22 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.803 0.441 . . . . 71.55 110.063 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -76.26 -60.31 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.326 -0.852 . . . . 75.1 111.384 -172.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.44 -56.23 7.12 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.763 0.425 . . . . 74.24 111.239 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -95.97 -11.55 26.37 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.267 0.84 . . . . 75.41 113.267 -168.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 55.28 71.41 0.54 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.809 0.844 . . . . 74.14 111.393 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.57 ' SD ' HD12 ' A' ' 116' ' ' LEU . 55.7 ttm -104.84 123.5 39.82 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 122.997 0.519 . . . . 71.32 110.115 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -82.39 76.3 4.24 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.499 2.133 . . . . 75.05 112.396 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 31.9 m -73.54 136.43 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 109.302 -0.629 . . . . 74.43 109.302 172.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.1 t -141.6 -46.28 0.02 OUTLIER Pre-proline 0 CA--C 1.556 1.191 0 CA-C-O 118.005 -0.998 . . . . 73.24 112.361 -173.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -52.26 -45.74 37.38 Favored 'Trans proline' 0 C--N 1.397 3.094 0 C-N-CA 122.054 1.836 . . . . 64.14 112.615 171.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 11.4 tt -144.15 143.93 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 N-CA-C 108.681 -0.859 . . . . 75.41 108.681 176.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.6 m -145.26 -59.57 0.34 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.99 0.516 . . . . 72.42 110.67 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -77.11 -49.55 15.02 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.192 0.997 . . . . 75.53 109.386 -173.486 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 86.84 -28.2 5.57 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 114.94 0.736 . . . . 74.11 114.94 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -72.93 -14.7 61.51 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 117.551 0.675 . . . . 61.53 112.706 -174.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.7 t -61.53 -21.67 64.46 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 122.989 0.516 . . . . 64.23 111.421 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -54.61 -43.23 72.05 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.614 0.765 . . . . 72.53 111.057 172.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.77 -19.93 60.29 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 112.51 0.559 . . . . 64.42 112.51 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -91.41 -60.68 1.83 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.868 0.867 . . . . 74.32 110.783 170.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.48 -62.68 1.52 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.785 1.234 . . . . 74.41 111.55 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.69 66.82 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.344 -1.298 . . . . 75.32 111.527 -176.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.426 ' HA ' HD13 ' A' ' 96' ' ' ILE . 36.2 tt0 -72.34 -56.21 5.86 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.65 0.594 . . . . 72.12 111.601 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.418 ' O ' ' HB3' ' A' ' 142' ' ' ASP . 13.5 mm100 -69.22 -28.03 66.0 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.729 0.643 . . . . 74.54 111.407 -176.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -86.74 -28.46 23.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.952 -0.567 . . . . 65.43 110.593 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.611 ' HB3' HH22 ' A' ' 30' ' ' ARG . . . -72.34 -26.56 61.97 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 109.825 -0.435 . . . . 73.45 109.825 168.102 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.577 ' HA ' ' HD2' ' A' ' 95' ' ' LYS . 25.5 t70 -62.58 -52.66 62.53 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 123.933 0.77 . . . . 53.35 108.941 172.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -60.87 -37.27 81.56 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.603 1.19 . . . . 74.14 113.138 174.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.489 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.9 t0 -76.94 -46.28 24.74 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.022 0.378 . . . . 74.04 112.022 -174.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.454 ' HD3' ' HG3' ' A' ' 95' ' ' LYS . 78.5 ttt180 -63.41 -36.54 84.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.492 0.717 . . . . 75.22 110.487 173.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -57.33 -47.21 82.17 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 115.565 -0.743 . . . . 72.42 109.507 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.35 -32.8 74.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.168 0.917 . . . . 75.22 111.889 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.405 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 1.1 t80 -65.24 -43.14 92.36 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.237 0.615 . . . . 73.51 109.854 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -85.07 -20.34 30.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.136 0.574 . . . . 71.44 111.645 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -79.67 -62.69 1.61 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.03 0.532 . . . . 73.14 109.933 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 92.9 mt 46.26 109.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 126.277 1.831 . . . . 73.44 113.619 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -106.21 77.75 1.25 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.516 -0.92 . . . . 73.33 108.516 -176.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -161.25 -87.12 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.15 -0.932 . . . . 72.42 109.367 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -148.76 115.55 6.0 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 107.731 -1.211 . . . . 72.11 107.731 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -108.82 128.99 55.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.441 0.696 . . . . 75.3 110.598 -173.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 CA--C 1.549 0.914 0 C-N-CA 123.822 0.849 . . . . 74.21 109.117 -179.177 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.414 ' SD ' ' O ' ' A' ' 1' ' ' MET . 11.8 tmm? . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 119.438 -0.315 . . . . 63.54 110.914 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -59.7 -35.25 74.13 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 118.167 0.44 . . . . 63.24 111.93 -172.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.96 -32.52 72.96 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.949 0.499 . . . . 72.52 111.338 177.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.471 ' O ' ' HB ' ' A' ' 7' ' ' ILE . 5.9 tt -68.3 -39.64 81.99 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.391 0.676 . . . . 75.15 109.363 174.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -68.13 -29.85 68.85 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.199 0.2 . . . . 74.53 110.802 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -70.59 -34.74 72.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 119.159 -0.448 . . . . 72.11 110.416 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 4' ' ' LEU . 61.2 mt -56.26 -47.88 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.679 0.792 . . . . 74.44 110.085 169.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.2 mm -59.36 -46.93 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 115.249 -0.887 . . . . 65.23 111.16 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' HG22 ' A' ' 13' ' ' VAL . 87.2 m -60.8 -47.46 86.23 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.876 0.871 . . . . 71.41 110.757 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -57.81 -50.62 72.67 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 123.948 0.78 . . . . 75.31 110.76 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.06 -35.05 91.5 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.602 1.189 . . . . 63.55 113.487 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -72.39 -39.71 67.79 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 122.686 0.395 . . . . 74.31 110.194 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.438 HG11 HD22 ' A' ' 73' ' ' ASN . 98.6 t -72.96 -26.73 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.275 0.63 . . . . 74.2 110.257 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.574 HG21 HG22 ' A' ' 35' ' ' VAL . 26.4 mt -60.13 -53.49 47.94 Favored 'Isoleucine or valine' 0 C--N 1.361 1.068 0 N-CA-C 108.897 -0.779 . . . . 70.22 108.897 171.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -57.23 -41.09 78.86 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.321 1.013 . . . . 74.34 110.94 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -53.84 -59.64 4.36 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 124.169 0.918 . . . . 74.0 112.103 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -84.13 -16.56 43.16 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 113.703 1.001 . . . . 74.22 113.703 -172.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.51 -20.55 65.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.952 0.901 . . . . 74.11 111.952 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -58.46 -19.48 37.11 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 113.269 0.84 . . . . 65.5 113.269 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -67.19 -20.2 65.68 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.804 0.668 . . . . 74.55 112.804 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.3 mmt -79.12 85.4 5.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.251 0.548 . . . . 73.11 110.752 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -75.21 -33.87 61.43 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.609 -1.256 . . . . 74.1 107.609 166.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.508 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 46.4 m-85 -92.33 162.87 14.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 114.619 -1.173 . . . . 73.32 110.37 173.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.407 ' SG ' HD11 ' A' ' 97' ' ' LEU . 68.9 m 54.32 65.55 1.48 Allowed 'General case' 0 C--N 1.354 0.766 0 O-C-N 124.636 1.21 . . . . 52.13 109.637 -170.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.456 ' HG3' ' HG3' ' A' ' 26' ' ' LYS . 49.4 pttt -53.22 -50.07 65.48 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 114.771 -1.104 . . . . 72.22 110.524 -174.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 5.5 mtpm? -80.77 -25.43 37.95 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-O 118.349 -0.834 . . . . 73.41 111.322 -172.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.817 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 18.1 mm-40 -70.56 -36.33 73.57 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 119.196 0.907 . . . . 74.41 109.775 175.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.0 t -67.08 -45.81 76.17 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 74.12 110.359 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.84 -33.4 66.13 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.327 -0.851 . . . . 73.53 111.238 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.688 HH22 ' HB1' ' A' ' 141' ' ' ALA . 16.6 ttm180 -69.99 -45.81 66.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.462 -0.57 . . . . 72.23 109.462 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.442 HD21 HD11 ' A' ' 76' ' ' ILE . 41.8 tp -62.89 -46.14 89.26 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 124.114 0.884 . . . . 75.53 109.696 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.52 -47.3 91.4 Favored Glycine 0 C--N 1.346 1.086 0 O-C-N 123.723 0.639 . . . . 74.33 112.614 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -60.67 -49.74 76.32 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.71 0.804 . . . . 75.43 111.12 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.513 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 17.1 mtt180 -61.66 -64.12 1.04 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.754 -1.112 . . . . 72.03 109.955 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.574 HG22 HG21 ' A' ' 14' ' ' ILE . 61.2 t -56.07 -46.73 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 124.14 0.9 . . . . 74.53 111.929 -171.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.232 0.332 . . . . 75.31 110.502 176.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.0 -20.0 74.26 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 114.307 0.483 . . . . 74.14 114.307 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 49.5 mt -87.23 -46.82 9.38 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.504 0.722 . . . . 75.43 110.792 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.424 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 12.4 pt -77.75 -38.9 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-O 118.925 -0.56 . . . . 74.11 111.482 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -56.48 -46.06 99.86 Favored Pre-proline 0 N--CA 1.487 1.386 0 N-CA-C 113.795 1.035 . . . . 74.23 113.795 -171.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -54.44 -51.67 9.98 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 121.581 1.521 . . . . 74.51 111.276 172.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.77 -31.28 72.22 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 115.452 -0.794 . . . . 74.33 111.662 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -66.44 -60.5 2.68 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.748 0.819 . . . . 75.51 110.576 178.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.2 ptp -61.11 -36.33 79.43 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 124.111 0.882 . . . . 73.34 111.455 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.602 HD13 ' SD ' ' A' ' 122' ' ' MET . 82.9 mt -67.42 -47.59 69.78 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.504 0.721 . . . . 74.42 110.305 177.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -61.57 -35.07 76.75 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.811 0.694 . . . . 74.43 111.727 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -64.5 -37.9 89.16 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.085 0.554 . . . . 74.1 111.437 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.18 -46.91 13.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.574 0.75 . . . . 73.12 110.522 -177.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -166.37 146.94 11.43 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.337 -0.392 . . . . 72.3 112.783 -175.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.53 161.75 17.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.682 0.793 . . . . 75.53 109.392 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -113.54 98.06 6.83 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.167 0.587 . . . . 72.35 109.697 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.0 m -80.03 150.2 30.45 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.05 0.54 . . . . 74.12 110.141 174.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 39.1 t 60.58 73.01 0.66 Allowed Pre-proline 0 CA--C 1.557 1.218 0 C-N-CA 125.003 1.321 . . . . 72.4 110.068 -170.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -83.5 174.58 8.76 Favored 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.741 2.294 . . . . 71.12 111.781 174.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.432 ' HG ' HD22 ' A' ' 58' ' ' LEU . 81.1 p -86.59 178.5 7.04 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.89 0.376 . . . . 62.51 110.952 178.213 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.56 -33.95 76.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.127 -0.942 . . . . 73.25 110.228 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.531 ' HB3' HD22 ' A' ' 115' ' ' LEU . 35.7 mtmm -58.1 -55.18 38.26 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.589 0.756 . . . . 71.11 110.573 174.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.541 HD23 HD13 ' A' ' 115' ' ' LEU . 4.4 mm? -59.82 -49.38 77.92 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.646 0.778 . . . . 74.33 111.537 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.8 m -58.41 -50.42 73.74 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 123.931 0.769 . . . . 73.3 111.206 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.6 m -68.82 -36.51 78.31 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.319 0.648 . . . . 74.11 111.53 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -68.79 -44.24 74.0 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.645 -0.502 . . . . 75.21 109.645 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -40.33 96.66 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.987 -1.006 . . . . 71.12 111.44 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -66.83 -42.49 85.72 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.202 0.601 . . . . 73.11 111.538 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -69.15 -42.15 76.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.62 0.768 . . . . 73.25 111.027 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.412 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 20.1 t80 -71.03 -37.79 72.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.132 0.973 . . . . 73.44 110.102 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.5 ttpp -61.75 -51.19 69.37 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.289 -0.868 . . . . 74.54 109.077 174.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.66 -41.31 73.45 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.17 0.919 . . . . 75.21 111.713 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.518 ' HB2' HD11 ' A' ' 105' ' ' LEU . . . -62.27 -43.41 98.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.967 -1.015 . . . . 64.52 111.746 177.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.8 mt -75.79 -25.96 56.86 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.171 0.588 . . . . 72.11 112.214 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 52.8 mt-10 -65.74 -45.77 81.36 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.215 0.606 . . . . 75.52 109.404 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.17 -39.25 78.85 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.637 -1.165 . . . . 74.22 111.011 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -64.08 -43.37 95.62 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.5 0.5 . . . . 54.33 110.736 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.438 HD22 HG11 ' A' ' 13' ' ' VAL . 11.3 t-20 -61.59 -46.73 88.62 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 124.547 1.154 . . . . 75.11 109.734 179.104 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -61.22 -42.11 99.69 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.081 -0.963 . . . . 73.34 112.446 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -59.41 -53.15 61.44 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 118.931 -0.557 . . . . 73.33 111.667 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.501 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -65.71 -28.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 N-CA-C 112.446 0.536 . . . . 73.41 112.446 178.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -64.64 -33.13 75.22 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.444 0.298 . . . . 74.25 110.687 172.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 42.2 mttm -85.5 -28.09 25.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.021 0.529 . . . . 72.22 111.012 176.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.501 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.3 m-85 -76.67 -2.84 34.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.935 0.894 . . . . 75.03 112.135 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -57.69 -25.32 60.11 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.346 0.659 . . . . 73.0 110.378 170.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -84.46 107.29 16.63 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 107.712 -1.218 . . . . 74.41 107.712 164.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -72.91 -23.65 60.73 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.469 0.708 . . . . 73.01 110.736 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.2 p -68.73 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.128 0.971 . . . . 74.25 111.335 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -61.4 -41.6 97.4 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.79 0.836 . . . . 74.22 110.236 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.578 HG23 HD13 ' A' ' 97' ' ' LEU . 39.3 mt -56.89 -60.15 2.31 Favored 'Isoleucine or valine' 0 C--N 1.354 0.794 0 CA-C-N 115.109 -0.95 . . . . 74.54 109.479 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.2 t -58.27 -34.51 70.58 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 123.964 0.79 . . . . 71.55 111.631 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -59.63 -56.45 21.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.977 1.311 . . . . 73.41 110.885 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.91 -22.23 42.99 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.853 -0.158 . . . . 75.24 110.583 -177.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.2 tp -76.27 -33.96 59.12 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.58 0.752 . . . . 64.34 111.081 -172.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.3 t -68.95 -25.05 64.36 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 110.065 -0.346 . . . . 72.13 110.065 173.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.82 17.62 22.29 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.433 1.093 . . . . 72.13 111.326 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 91.3 p -67.69 113.24 5.31 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 109.276 -0.638 . . . . 74.43 109.276 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -70.88 -13.01 61.87 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.263 -0.88 . . . . 61.05 111.167 -176.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -118.44 -100.13 0.44 Allowed 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.419 -1.326 . . . . 72.01 107.419 167.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.445 ' HG3' HD12 ' A' ' 96' ' ' ILE . 14.9 pttm 175.54 -25.82 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.332 1.453 . . . . 72.53 110.335 -176.676 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.445 HD12 ' HG3' ' A' ' 95' ' ' LYS . 3.6 mp -72.17 131.18 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 108.985 -0.746 . . . . 75.14 108.985 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.817 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.0 tp -60.6 -40.67 92.65 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.694 0.759 . . . . 72.22 111.968 -171.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.417 ' HB3' ' HB ' ' A' ' 101' ' ' VAL . 5.0 m-85 -112.02 38.03 2.8 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.992 -1.004 . . . . 73.42 108.528 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.417 ' HE3' ' HB2' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -39.49 -53.53 2.05 Favored 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 113.568 0.951 . . . . 74.12 113.568 -160.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.54 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 34.6 t70 -80.07 -40.7 27.09 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.372 0.669 . . . . 73.42 110.74 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 98' ' ' PHE . 56.3 t -62.91 -54.43 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.644 0.777 . . . . 73.15 111.371 -177.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -69.45 -26.06 64.4 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.034 0.934 . . . . 71.43 111.213 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -35.75 77.14 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.105 0.412 . . . . 73.42 110.993 164.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.9 mttm -66.01 -44.79 83.72 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.221 -0.659 . . . . 74.41 109.221 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.518 HD11 ' HB2' ' A' ' 68' ' ' ALA . 10.8 mp -53.47 -44.89 69.31 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.354 0.409 . . . . 75.32 109.972 174.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.423 ' HA ' ' CZ3' ' A' ' 133' ' ' TRP . 21.1 m -62.88 -57.64 10.12 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.776 0.673 . . . . 75.31 112.108 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.67 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.1 t70 -72.43 -41.71 65.87 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 114.865 -1.061 . . . . 51.14 110.692 -169.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 51.4 t -74.2 -28.79 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 115.862 -0.608 . . . . 75.22 110.882 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.403 ' CD2' HD21 ' A' ' 38' ' ' LEU . 62.5 t-105 -67.83 -37.91 82.54 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.37 0.532 . . . . 72.43 110.439 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.67 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.7 mtpt -55.12 -52.73 62.33 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.523 -0.547 . . . . 75.11 109.523 173.357 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 39.7 mt-10 -53.74 -51.73 62.39 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 124.424 1.078 . . . . 75.51 111.028 174.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.579 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -66.06 -55.24 17.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.054 0.942 . . . . 73.53 109.651 -168.464 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.2 p -59.63 -40.34 87.32 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.394 0.678 . . . . 74.41 112.0 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.7 pp -64.08 -43.01 96.71 Favored 'General case' 0 C--N 1.37 1.457 0 CA-C-N 118.139 0.427 . . . . 72.44 110.839 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.541 HD13 HD23 ' A' ' 58' ' ' LEU . 4.2 pp -74.6 -20.99 59.71 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.476 0.547 . . . . 73.01 112.476 177.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 43.0 mt -69.42 -36.78 77.03 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 110.041 -0.355 . . . . 75.02 110.041 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.479 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.02 -38.34 44.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.321 0.648 . . . . 74.24 111.419 178.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 49.9 t -74.57 -62.63 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.339 0.656 . . . . 75.4 111.138 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -89.8 -57.11 2.98 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 122.383 -0.198 . . . . 64.01 111.382 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 116' ' ' LEU . 31.7 mm-40 -67.12 -23.19 65.79 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.638 0.586 . . . . 70.14 111.899 -172.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 56.89 32.22 21.07 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.332 1.053 . . . . 75.53 111.848 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.602 ' SD ' HD13 ' A' ' 45' ' ' LEU . 41.4 mtm -91.29 146.17 32.91 Favored Pre-proline 0 N--CA 1.467 0.422 0 N-CA-C 108.818 -0.808 . . . . 75.12 108.818 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -84.78 39.59 0.76 Allowed 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 123.06 2.507 . . . . 73.33 112.287 -173.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.9 t -81.11 90.48 1.83 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 123.846 0.858 . . . . 73.44 109.98 -175.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 41.6 t -143.35 73.68 17.57 Favored Pre-proline 0 CA--C 1.546 0.804 0 CA-C-N 114.603 -1.18 . . . . 73.24 108.816 174.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -89.42 23.37 0.73 Allowed 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 123.342 2.695 . . . . 73.1 111.776 174.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.5 tt -156.29 144.52 11.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 124.276 1.03 . . . . 72.53 108.933 -172.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 26.3 m -82.39 85.04 6.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.475 0.71 . . . . 64.23 109.702 176.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 72.44 -69.27 0.19 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 125.567 1.547 . . . . 75.32 111.321 175.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.79 5.82 7.44 Favored Glycine 0 N--CA 1.471 1.02 0 CA-C-O 119.481 -0.622 . . . . 45.23 114.221 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 117.38 0.59 . . . . 75.34 110.489 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 21.9 m -68.83 -20.35 64.3 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 115.171 -0.922 . . . . 70.53 112.662 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.423 ' CZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER -60.17 -31.38 70.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.632 0.773 . . . . 74.05 111.558 -179.629 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -32.33 73.82 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.697 0.399 . . . . 75.32 111.424 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . 0.428 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 46.7 mt-30 -84.12 -37.87 21.43 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.775 0.83 . . . . 75.34 110.838 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.85 -52.65 64.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.42 1.088 . . . . 75.51 110.73 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.69 -37.28 86.02 Favored 'General case' 0 C--O 1.239 0.506 0 O-C-N 124.665 1.228 . . . . 65.33 112.907 -174.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . 0.428 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.73 -48.68 63.18 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 109.922 -0.399 . . . . 75.24 109.922 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -63.37 -37.9 89.08 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.298 0.571 . . . . 74.13 111.441 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.13 -49.54 76.82 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.408 1.083 . . . . 71.52 109.722 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.688 ' HB1' HH22 ' A' ' 30' ' ' ARG . . . -74.51 -21.14 59.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.074 -0.966 . . . . 72.12 112.052 -178.703 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -64.81 -54.41 31.62 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.89 -0.781 . . . . 74.3 108.89 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.27 -39.35 92.49 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.269 0.981 . . . . 71.12 110.502 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.484 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 39.5 t0 -74.37 -48.52 27.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.661 -0.699 . . . . 74.53 112.163 -174.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 36.6 ttt-85 -65.65 -34.37 78.06 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.527 -0.546 . . . . 75.35 109.527 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -57.96 -48.68 79.25 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 123.603 0.565 . . . . 75.51 109.648 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.58 77.58 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.885 0.741 . . . . 73.23 111.8 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.508 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.9 OUTLIER -72.98 -49.18 30.56 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.612 0.57 . . . . 75.02 110.448 -178.722 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -81.55 -10.68 59.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.757 -0.656 . . . . 72.05 111.765 -172.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.605 ' SD ' ' HB2' ' A' ' 152' ' ' ARG . 1.5 tmt? -96.24 -59.82 1.75 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.144 -1.058 . . . . 73.13 108.144 173.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 155' ' ' ASN . 0.1 OUTLIER 40.81 65.69 0.75 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 125.957 1.703 . . . . 72.3 112.341 174.215 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . 0.605 ' HB2' ' SD ' ' A' ' 150' ' ' MET . 2.0 tmt_? -101.0 -23.47 14.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.52 -0.919 . . . . 75.11 108.52 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -43.78 -49.15 8.14 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.425 1.49 . . . . 70.54 112.001 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -171.68 109.86 0.28 Allowed 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.382 1.051 . . . . 45.24 109.969 169.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . 0.504 ' HB2' HD12 ' A' ' 151' ' ' LEU . 50.3 t30 -150.99 104.19 3.12 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.6 0.76 . . . . 74.14 109.451 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 . . . . . 0 CA--C 1.557 1.213 0 C-N-CA 125.645 1.578 . . . . 64.44 112.336 176.268 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.417 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 121.638 0.733 . . . . 62.52 110.106 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -69.78 -42.87 73.21 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 74.22 110.179 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.497 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 95.7 m-20 -58.45 -46.69 86.05 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.667 -0.697 . . . . 75.04 110.342 174.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.461 ' O ' HG12 ' A' ' 8' ' ' ILE . 42.6 mt -63.78 -40.49 96.8 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.863 0.727 . . . . 73.22 111.134 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -59.52 -48.42 81.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.762 -0.829 . . . . 64.53 108.762 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -66.08 -49.12 68.69 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-O 118.901 -0.571 . . . . 73.13 111.118 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.2 mt -54.42 -47.65 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.831 0.852 . . . . 72.52 111.275 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.461 HG12 ' O ' ' A' ' 4' ' ' LEU . 20.8 mm -66.78 -46.74 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.166 -0.925 . . . . 74.1 110.958 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -63.19 -44.0 96.59 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.536 0.522 . . . . 72.32 110.646 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.8 mt -55.49 -58.93 5.73 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.41 0.684 . . . . 72.54 109.835 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.81 -38.33 95.78 Favored Glycine 0 C--N 1.348 1.245 0 O-C-N 124.443 1.089 . . . . 71.43 114.609 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -70.98 -47.65 57.72 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 123.192 0.597 . . . . 72.02 110.259 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.434 HG13 ' HD2' ' A' ' 17' ' ' ARG . 90.6 t -64.48 -31.35 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 115.631 -0.713 . . . . 75.15 110.01 174.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.549 HG12 HD13 ' A' ' 76' ' ' ILE . 14.5 mt -59.02 -49.89 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.946 0.899 . . . . 72.32 109.712 174.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -60.44 -42.49 96.21 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 123.946 0.779 . . . . 74.53 111.322 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -67.11 -58.04 5.64 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.309 0.381 . . . . 73.52 111.456 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.434 ' HD2' HG13 ' A' ' 13' ' ' VAL . 1.4 ptm180 -72.07 -19.78 61.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.742 0.817 . . . . 73.04 112.992 -167.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 35.1 t -61.66 -16.04 45.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.919 0.888 . . . . 72.24 112.059 176.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -55.01 -12.81 0.92 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.006 1.113 . . . . 74.42 114.006 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -66.24 -18.73 65.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.381 0.673 . . . . 74.32 112.609 176.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.501 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 7.7 mmt -70.55 93.64 0.92 Allowed 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.081 0.467 . . . . 75.51 110.716 -175.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.547 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 11.3 mmmm -68.76 -43.93 74.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.016 0.926 . . . . 75.3 110.252 171.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -101.97 175.05 5.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.833 -1.531 . . . . 72.14 109.546 166.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.493 ' SG ' HG21 ' A' ' 85' ' ' ILE . 83.5 m 58.52 45.04 16.99 Favored 'General case' 0 C--O 1.243 0.735 0 O-C-N 124.095 0.872 . . . . 73.01 110.844 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -74.37 -45.23 48.3 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 114.627 -1.169 . . . . 72.42 110.658 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.508 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.9 mtpm? -65.07 -33.5 76.17 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.07 -0.715 . . . . 75.1 109.07 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.455 ' HB2' ' OD1' ' A' ' 144' ' ' ASP . 3.1 tp-100 -55.41 -47.02 76.56 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 123.893 0.746 . . . . 70.05 110.492 170.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.624 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 42.5 t -73.98 -21.97 59.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.201 1.0 . . . . 74.52 112.031 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -45.78 53.73 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.426 0.691 . . . . 73.41 109.739 174.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.432 ' NH2' ' HB1' ' A' ' 141' ' ' ALA . 21.9 ttp85 -75.33 -39.32 59.54 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.456 -0.793 . . . . 73.11 110.856 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.7 tp -62.86 -44.44 96.13 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.826 -0.805 . . . . 71.41 108.826 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.21 -52.67 47.98 Favored Glycine 0 C--N 1.349 1.267 0 O-C-N 124.384 1.053 . . . . 74.42 112.025 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -69.45 -34.12 73.93 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.092 0.557 . . . . 75.25 112.424 -177.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.635 HH12 ' HB2' ' A' ' 106' ' ' SER . 14.4 mtt180 -65.45 -58.81 4.92 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.092 -0.707 . . . . 72.24 109.092 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.4 ' O ' HG12 ' A' ' 39' ' ' ILE . 53.3 t -55.89 -44.81 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 124.435 1.084 . . . . 73.22 111.279 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.436 HD22 HD13 ' A' ' 39' ' ' ILE . 75.6 mt -62.14 -38.83 90.46 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.643 0.589 . . . . 74.44 110.666 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -71.89 -20.5 78.83 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.803 -0.443 . . . . 73.34 113.563 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 60.8 mt -85.71 -45.98 11.14 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.044 0.537 . . . . 71.4 111.137 177.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.436 HD13 HD22 ' A' ' 36' ' ' LEU . 14.3 pt -78.34 -43.22 26.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 118.869 -0.586 . . . . 71.44 110.904 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -52.4 -53.65 50.83 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 114.37 1.248 . . . . 75.11 114.37 -173.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.35 -32.64 81.37 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.768 1.645 . . . . 73.42 112.459 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 46' ' ' GLN . 4.3 mm? -75.16 -37.01 61.48 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.757 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -67.06 -40.5 87.09 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.585 1.154 . . . . 75.42 111.25 -177.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.454 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 30.0 mmt -60.67 -40.28 91.52 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.984 0.803 . . . . 75.12 110.542 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.9 mt -80.7 -26.33 37.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.615 0.766 . . . . 75.41 111.481 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -74.76 -29.22 61.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.106 0.962 . . . . 72.45 109.942 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -59.28 -34.24 72.04 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.306 0.642 . . . . 75.11 110.899 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -75.27 -55.57 5.58 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.525 -0.917 . . . . 75.41 108.525 169.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 60.74 23.91 61.61 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-N 115.334 -0.848 . . . . 61.13 113.25 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -77.88 171.42 15.01 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.89 0.876 . . . . 74.54 110.587 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -64.22 146.26 54.61 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.183 0.516 . . . . 75.53 111.118 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.3 m -132.13 -157.59 0.83 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 107.92 -1.141 . . . . 53.31 107.92 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 45.2 t -106.07 89.94 4.16 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 108.168 -1.049 . . . . 72.24 108.168 167.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.568 ' HA ' HD11 ' A' ' 58' ' ' LEU . 14.8 Cg_exo -71.04 162.95 40.94 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 122.828 2.352 . . . . 75.12 112.365 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.504 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 43.6 t -158.68 160.17 36.14 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.359 0.664 . . . . 74.43 109.806 -173.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.41 -27.85 65.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.69 -0.687 . . . . 54.11 110.602 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -74.2 -30.54 62.25 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.859 0.464 . . . . 73.1 111.028 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.568 HD11 ' HA ' ' A' ' 54' ' ' PRO . 59.1 mt -69.46 -41.77 75.78 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.437 0.461 . . . . 74.23 109.978 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.4 m -61.14 -49.0 79.04 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 124.181 0.925 . . . . 70.1 109.933 175.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 79.9 m -60.98 -40.43 93.43 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.75 0.656 . . . . 74.52 111.24 178.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.29 -50.11 72.97 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.684 0.794 . . . . 74.25 110.854 179.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.497 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.6 mmt -72.63 -19.38 61.46 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 115.271 -0.877 . . . . 70.31 112.34 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.475 ' HA ' ' HZ3' ' A' ' 66' ' ' LYS . 93.2 m-20 -78.22 -44.12 26.51 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 122.916 0.486 . . . . 70.45 110.248 174.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -60.6 -46.18 91.2 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.191 0.996 . . . . 74.11 109.914 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.418 ' O ' HD22 ' A' ' 69' ' ' LEU . 1.9 t80 -65.83 -50.92 62.89 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 114.569 -1.196 . . . . 72.44 109.444 -176.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.487 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 ttpm? -54.45 -46.57 73.31 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.455 0.702 . . . . 74.22 111.065 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.99 -43.71 94.99 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 124.038 0.836 . . . . 74.22 111.17 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.456 ' HB1' HD13 ' A' ' 105' ' ' LEU . . . -66.57 -39.2 88.36 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.632 -0.713 . . . . 73.55 111.546 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.418 HD22 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -65.64 -34.15 77.55 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.22 1.008 . . . . 71.01 111.299 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 80.9 mm-40 -61.06 -49.7 76.29 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.313 0.645 . . . . 73.05 109.283 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 33.7 mt-10 -59.32 -44.19 92.61 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.291 -1.322 . . . . 74.33 111.032 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.55 -42.98 99.88 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 123.914 0.759 . . . . 75.4 111.34 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -61.47 -36.42 80.39 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.812 0.695 . . . . 72.52 110.101 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -70.2 -36.72 71.43 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 114.83 -1.077 . . . . 65.44 112.328 177.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.493 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 11.5 mm-40 -62.63 -51.43 67.31 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 122.881 0.472 . . . . 54.11 109.774 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.556 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 2.3 pt -74.63 -19.39 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 112.566 0.58 . . . . 73.0 112.566 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.79 -40.63 93.35 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.606 -0.516 . . . . 71.3 109.606 167.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 77.1 mttt -74.77 -45.42 43.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.498 0.719 . . . . 73.52 110.616 175.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.556 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.5 m-30 -73.32 -4.28 32.32 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.116 0.966 . . . . 72.33 112.542 -173.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.9 p -57.33 -32.12 66.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.083 0.553 . . . . 72.54 110.234 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -84.43 118.8 24.49 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.149 -0.932 . . . . 72.44 109.265 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.547 ' HG2' ' HB2' ' A' ' 22' ' ' LYS . 4.1 mpt_? -74.14 -31.72 62.86 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.429 1.092 . . . . 74.45 110.046 -176.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.7 m -64.93 -36.05 83.14 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.813 -1.085 . . . . 74.31 111.04 174.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.4 -40.7 97.92 Favored 'General case' 0 C--O 1.252 1.185 0 C-N-CA 123.436 0.695 . . . . 74.42 110.532 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.493 HG21 ' SG ' ' A' ' 24' ' ' CYS . 21.8 mt -58.91 -55.48 23.08 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 O-C-N 124.133 0.895 . . . . 75.21 109.536 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.7 t -56.22 -40.03 73.41 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.862 0.726 . . . . 65.14 111.911 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.8 -46.09 91.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.92 0.888 . . . . 73.43 111.452 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.28 -22.96 30.54 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 119.552 -0.261 . . . . 73.34 110.648 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 tp -73.3 -36.57 66.3 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.85 0.86 . . . . 75.31 110.662 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -74.65 -14.49 60.76 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.119 -0.946 . . . . 64.32 110.28 175.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -108.82 11.15 26.4 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.541 1.136 . . . . 73.42 110.163 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.7 t -114.12 127.05 55.74 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 124.035 0.934 . . . . 73.42 108.932 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.97 -20.48 24.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.851 0.861 . . . . 75.1 109.968 -178.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -92.93 164.84 13.16 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.921 0.888 . . . . 75.31 111.323 -172.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -85.42 -47.35 10.05 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.672 1.189 . . . . 75.21 111.032 -174.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.7 mp -81.11 117.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.351 0.645 0 N-CA-C 109.133 -0.692 . . . . 74.51 109.133 -169.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.483 HD12 HG22 ' A' ' 85' ' ' ILE . 12.0 tp -60.68 -30.87 70.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.968 1.307 . . . . 74.11 111.875 -175.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -111.65 13.06 21.21 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.679 -1.153 . . . . 74.11 111.423 -175.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -37.15 -57.86 0.84 Allowed 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 114.512 1.301 . . . . 73.23 114.512 -159.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 16.3 t70 -54.84 -62.44 1.66 Allowed 'General case' 0 N--CA 1.479 0.983 0 O-C-N 124.432 1.083 . . . . 74.43 110.749 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.03 -49.04 85.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 CA-C-N 114.903 -1.044 . . . . 73.55 111.676 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.7 -28.62 67.01 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.344 0.658 . . . . 74.44 111.331 -175.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -69.65 -34.17 73.64 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.366 -0.605 . . . . 74.13 109.366 172.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.1 mtpt -66.74 -42.64 85.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 119.148 -0.453 . . . . 72.35 110.873 174.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.456 HD13 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -59.83 -40.11 87.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 109.762 -0.458 . . . . 75.54 109.762 171.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.635 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.6 t -66.86 -42.53 85.52 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.765 0.666 . . . . 71.32 111.758 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -70.14 -47.63 60.88 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.659 0.783 . . . . 73.4 109.856 -177.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 45.6 t -72.88 -21.7 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.171 -0.922 . . . . 75.24 110.873 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.418 ' HA ' ' HB2' ' A' ' 112' ' ' LEU . 42.5 t-105 -78.54 -35.24 46.44 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 118.469 0.577 . . . . 74.24 110.855 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -57.71 -52.52 65.1 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.616 -0.883 . . . . 74.33 108.616 172.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 49.7 mt-10 -57.69 -49.3 76.95 Favored 'General case' 0 C--N 1.351 0.631 0 CA-C-N 114.359 -1.291 . . . . 65.25 110.261 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.5 OUTLIER -54.75 -60.5 3.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.512 1.132 . . . . 75.51 109.444 -174.503 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 84.4 p -59.18 -37.19 76.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.269 -0.878 . . . . 73.12 111.501 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.5 -57.29 8.6 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 111.922 0.341 . . . . 74.45 111.922 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 3.6 pp -66.28 -35.28 79.99 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-N 117.982 0.355 . . . . 72.52 111.6 -175.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.534 HD22 ' SD ' ' A' ' 122' ' ' MET . 94.1 mt -67.82 -50.94 53.96 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 123.183 0.593 . . . . 74.4 110.57 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.16 -45.71 69.36 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.118 0.485 . . . . 74.03 112.062 -173.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 94.0 t -84.76 -42.41 16.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-N 115.378 -0.828 . . . . 75.0 111.39 -171.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.5 -57.75 2.31 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 109.47 -0.567 . . . . 75.53 109.47 -175.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -11.85 59.89 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 123.521 0.729 . . . . 73.01 111.308 -174.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 65.57 44.15 3.11 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 125.259 1.424 . . . . 72.33 112.017 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.534 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.5 mtp -110.5 112.63 56.56 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.49 1.116 . . . . 64.3 109.8 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -77.12 67.53 7.59 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.887 2.391 . . . . 71.32 112.061 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.0 m -109.36 94.24 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 C-N-CA 124.41 1.084 . . . . 64.2 110.304 -174.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 26.3 t -164.24 68.04 1.49 Allowed Pre-proline 0 CA--C 1.553 1.068 0 CA-C-N 115.629 -0.714 . . . . 73.1 109.21 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -90.25 4.67 4.61 Favored 'Trans proline' 0 C--N 1.377 2.066 0 C-N-CA 123.088 2.525 . . . . 75.43 114.002 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.477 HD11 ' CZ2' ' A' ' 133' ' ' TRP . 5.5 pt -139.74 84.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.304 0.641 . . . . 73.11 110.625 -170.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' SER . . . . . 0.445 ' HB3' ' HB2' ' A' ' 133' ' ' TRP . 37.6 t 62.34 178.42 0.13 Allowed 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.386 1.074 . . . . 52.04 111.538 177.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -30.21 45.84 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 107.992 -1.114 . . . . 54.31 107.992 170.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 122.0 -17.54 8.63 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.684 -0.689 . . . . 73.11 112.434 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.55 4.95 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.25 0.62 . . . . 63.31 110.673 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 45.9 t -70.9 -27.83 64.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.214 0.606 . . . . 73.51 110.52 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.51 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 5.8 t90 -60.1 -25.3 65.32 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.899 0.879 . . . . 73.42 111.344 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.22 -39.84 20.41 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.736 0.814 . . . . 63.55 111.491 173.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -67.74 -34.31 76.58 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.857 0.863 . . . . 74.22 111.518 -173.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.72 -35.08 70.19 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.47 -1.241 . . . . 74.51 111.024 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.66 -43.45 89.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.157 0.583 . . . . 73.5 111.557 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.47 -59.81 4.3 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.941 0.776 . . . . 74.31 110.259 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 29.4 tt0 -60.41 -54.18 48.64 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.197 0.936 . . . . 72.54 111.846 -175.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.41 -49.86 75.18 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.195 0.934 . . . . 74.53 110.857 -173.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.432 ' HB1' ' NH2' ' A' ' 30' ' ' ARG . . . -66.71 -31.28 71.84 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 124.159 0.912 . . . . 71.15 111.432 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.27 -52.66 62.81 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 123.636 0.585 . . . . 73.4 110.12 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 41.0 mt-10 -60.27 -36.08 77.0 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.263 0.977 . . . . 74.43 111.458 179.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.508 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.9 t70 -75.73 -50.21 15.98 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.371 1.068 . . . . 74.12 112.045 -172.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -66.03 -33.34 75.59 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.148 -0.686 . . . . 75.22 109.148 175.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -67.35 -32.23 73.03 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.048 0.539 . . . . 74.52 109.988 174.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.59 -21.86 60.2 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.244 0.618 . . . . 73.54 111.335 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -54.91 12.12 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.394 -0.595 . . . . 74.22 109.394 169.303 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.56 -47.52 85.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.386 0.674 . . . . 75.32 111.565 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 40.6 ttm -84.76 -72.74 0.46 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.599 0.76 . . . . 74.4 109.441 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 35.5 tp 64.68 151.51 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.347 1.459 . . . . 63.23 112.331 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -147.68 71.54 1.2 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.42 0.688 . . . . 75.52 109.687 171.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -164.2 -69.14 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.524 -0.762 . . . . 72.23 110.443 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -86.64 -77.44 0.32 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.287 -0.635 . . . . 63.33 109.287 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 17.4 m120 65.37 -171.21 0.19 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.588 1.155 . . . . 73.11 112.458 173.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 C--O 1.249 1.056 0 C-N-CA 124.518 1.127 . . . . 62.1 109.255 177.635 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 ttm . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 111.487 0.181 . . . . 71.23 111.487 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -34.37 73.08 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 122.903 0.481 . . . . 74.34 110.605 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.622 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 16.4 m120 -59.15 -59.7 5.04 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 123.891 0.745 . . . . 74.44 109.934 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.465 ' O ' HG12 ' A' ' 8' ' ' ILE . 56.8 mt -61.91 -39.53 92.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 124.29 0.994 . . . . 75.32 112.165 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.28 -48.06 81.66 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.431 0.692 . . . . 72.12 109.91 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -72.38 -41.57 66.2 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-O 118.766 -0.635 . . . . 75.15 111.528 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.6 mt -52.56 -49.26 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.648 0.779 . . . . 74.42 110.673 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.465 HG12 ' O ' ' A' ' 4' ' ' LEU . 28.6 mm -71.69 -41.53 71.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 114.685 -1.143 . . . . 63.53 111.202 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -61.51 -59.12 5.72 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 122.893 0.477 . . . . 73.33 110.053 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.413 ' O ' HG13 ' A' ' 14' ' ' ILE . 27.2 mt -52.06 -49.4 63.55 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.309 1.044 . . . . 73.01 111.517 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.48 ' HA2' HD11 ' A' ' 14' ' ' ILE . . . -64.08 -39.05 96.83 Favored Glycine 0 C--N 1.351 1.383 0 O-C-N 123.955 0.785 . . . . 70.1 114.081 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -69.47 -44.26 71.55 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 109.284 -0.636 . . . . 75.43 109.284 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.454 HG12 ' HD2' ' A' ' 17' ' ' ARG . 69.5 t -61.88 -31.35 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.2 1.0 . . . . 74.21 111.013 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.493 HG22 HG23 ' A' ' 35' ' ' VAL . 68.3 mt -61.03 -53.26 51.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 109.047 -0.723 . . . . 73.12 109.047 172.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -58.33 -30.61 66.84 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 123.884 0.74 . . . . 72.4 112.142 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -76.45 -51.44 11.78 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.893 0.477 . . . . 73.32 111.672 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.454 ' HD2' HG12 ' A' ' 13' ' ' VAL . 9.7 ptm180 -84.47 -19.53 33.21 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.977 0.511 . . . . 74.14 112.235 -169.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.62 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 21.8 t -71.17 -19.84 62.36 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.499 0.72 . . . . 74.1 110.413 177.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -63.88 -13.17 42.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.284 0.634 . . . . 74.52 111.675 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -28.54 70.14 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.491 0.717 . . . . 75.15 110.247 174.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.6 mmt -70.31 89.24 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.126 0.571 . . . . 74.41 110.138 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -77.81 -24.01 48.9 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.299 -1.0 . . . . 71.11 108.299 170.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.528 ' HD1' ' HG2' ' A' ' 82' ' ' ARG . 83.8 m-85 -104.23 171.79 7.15 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.624 1.17 . . . . 74.55 109.461 167.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.649 ' SG ' HG21 ' A' ' 85' ' ' ILE . 57.9 m 53.01 49.92 19.1 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 124.093 0.87 . . . . 61.5 110.936 -175.508 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.454 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 51.1 pttt -61.5 -49.68 75.78 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 113.726 -1.579 . . . . 75.52 111.904 -174.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.584 ' HB3' ' HB2' ' A' ' 140' ' ' ASP . 28.6 mmtp -67.31 -45.26 77.05 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.544 0.337 . . . . 73.35 111.648 -174.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.82 -33.14 75.16 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.114 0.565 . . . . 74.4 110.999 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.62 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 21.5 t -75.72 -38.51 58.5 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.938 0.895 . . . . 72.41 111.849 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.454 ' HG3' ' O ' ' A' ' 25' ' ' LYS . 50.9 mtp85 -66.86 -41.8 86.75 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.798 -0.445 . . . . 73.14 109.798 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.402 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 32.3 ttp85 -63.04 -47.83 81.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.32 -0.854 . . . . 74.21 110.84 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.508 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.2 tp -55.08 -57.73 10.52 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.677 0.61 . . . . 74.55 110.776 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -42.95 98.46 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.061 0.85 . . . . 71.33 113.571 -177.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -60.02 -46.39 89.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.314 0.646 . . . . 65.25 111.514 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.497 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 70.2 mtt-85 -61.55 -53.83 51.16 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.837 0.71 . . . . 75.42 110.333 178.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.493 HG23 HG22 ' A' ' 14' ' ' ILE . 77.1 t -53.62 -43.54 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 124.168 0.918 . . . . 74.24 111.415 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.486 HD23 HD12 ' A' ' 39' ' ' ILE . 72.5 mt -63.4 -46.16 87.69 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 123.695 0.622 . . . . 72.24 111.147 177.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.94 -22.81 65.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.084 -0.507 . . . . 55.01 113.31 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.562 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 36.6 mt -87.0 -42.55 13.02 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.452 0.701 . . . . 75.24 112.546 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.486 HD12 HD23 ' A' ' 36' ' ' LEU . 18.7 pt -80.94 -40.14 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 112.096 0.406 . . . . 74.31 112.096 -172.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -57.55 -44.04 99.29 Favored Pre-proline 0 N--CA 1.486 1.374 0 N-CA-C 114.257 1.206 . . . . 74.34 114.257 -173.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.599 ' HA ' ' HE2' ' A' ' 44' ' ' MET . 13.5 Cg_endo -55.94 -31.84 83.32 Favored 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 122.325 2.016 . . . . 65.35 112.609 174.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.416 HD13 HD21 ' A' ' 45' ' ' LEU . 3.3 mm? -83.25 -29.87 28.1 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.044 -0.526 . . . . 73.44 110.383 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.54 -31.84 72.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.985 0.514 . . . . 64.11 110.837 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.599 ' HE2' ' HA ' ' A' ' 41' ' ' PRO . 72.5 mtm -65.89 -45.84 80.55 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 123.423 0.452 . . . . 72.55 111.556 178.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.416 HD21 HD13 ' A' ' 42' ' ' LEU . 4.3 pp -76.35 -26.97 56.27 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.277 0.231 . . . . 75.24 111.167 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -64.3 -42.49 96.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.121 0.969 . . . . 72.13 109.704 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.48 -37.55 86.39 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.475 -1.239 . . . . 74.12 110.599 175.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -71.24 -30.01 65.8 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 116.005 -0.543 . . . . 71.41 111.071 175.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.17 31.83 78.32 Favored Glycine 0 C--N 1.356 1.654 0 O-C-N 123.684 0.615 . . . . 62.24 113.822 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -74.33 143.46 44.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.241 0.46 . . . . 72.02 112.241 -172.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -64.92 89.13 0.07 Allowed 'General case' 0 C--N 1.356 0.862 0 C-N-CA 124.266 1.027 . . . . 74.41 110.476 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.2 p -81.38 153.52 26.93 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.545 -0.752 . . . . 72.52 109.319 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.46 100.71 14.58 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 108.903 -0.777 . . . . 74.42 108.903 175.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -75.07 85.5 1.53 Allowed 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 122.399 2.066 . . . . 70.42 110.431 173.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.3 t -68.09 179.22 1.58 Allowed 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.156 -1.383 . . . . 64.44 110.0 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -54.22 -56.9 13.76 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.389 0.676 . . . . 72.32 110.147 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.459 ' HE3' ' HG3' ' A' ' 119' ' ' GLU . 47.0 pttt -68.77 -31.24 70.13 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.278 -0.874 . . . . 74.14 112.639 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.408 HD23 HD11 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -65.88 -55.74 15.44 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 108.702 -0.851 . . . . 71.23 108.702 -178.124 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 m -67.5 -36.05 80.33 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.2 -0.909 . . . . 75.24 111.372 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 100.0 m -62.31 -45.99 90.74 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 123.266 0.354 . . . . 74.32 110.962 177.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.78 94.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 123.571 0.544 . . . . 63.01 110.459 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.622 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 24.8 mmt -68.38 -25.97 65.33 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-N 115.588 -0.733 . . . . 64.11 112.252 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -75.7 -45.65 35.63 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.788 0.835 . . . . 73.42 110.269 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -62.88 -42.42 99.76 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.261 1.025 . . . . 71.1 110.245 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.562 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 6.3 t80 -67.03 -52.57 40.79 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 114.903 -1.044 . . . . 74.14 109.297 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.61 -47.12 63.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.41 1.084 . . . . 73.43 110.635 177.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.3 90.77 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.982 0.801 . . . . 72.54 111.486 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.469 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -65.19 -38.37 90.27 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.832 0.853 . . . . 74.43 111.512 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.448 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -63.37 -35.16 79.47 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.829 0.852 . . . . 75.4 111.046 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -68.69 -38.78 80.59 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.86 0.464 . . . . 74.22 111.171 175.043 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -59.24 -49.32 78.29 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 123.478 0.486 . . . . 74.14 109.954 176.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.74 -52.16 66.66 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.222 0.951 . . . . 72.21 111.634 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.44 -45.61 80.7 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.582 1.153 . . . . 73.12 111.758 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.38 -38.83 91.49 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.81 -1.086 . . . . 53.24 112.874 -176.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -76.84 -37.26 55.97 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.221 -0.895 . . . . 62.12 112.183 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.457 HG21 ' CZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -65.38 -32.53 58.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.492 1.042 . . . . 65.22 110.505 171.297 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.66 -47.5 84.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.323 -0.621 . . . . 63.4 109.323 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -71.6 -27.94 63.47 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.085 0.554 . . . . 64.43 112.248 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.77 4.51 36.58 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.743 0.817 . . . . 74.32 111.886 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.7 p -58.96 -26.44 64.43 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.019 0.438 . . . . 52.13 111.201 175.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -79.23 108.15 12.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.274 -1.01 . . . . 75.44 108.274 165.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.528 ' HG2' ' HD1' ' A' ' 23' ' ' TYR . 2.3 mpt_? -71.34 -24.08 62.04 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.28 0.632 . . . . 75.03 109.924 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.9 m -67.43 -35.74 79.85 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.724 0.81 . . . . 74.2 111.246 172.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.85 -41.0 99.18 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.051 0.94 . . . . 73.14 110.067 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 24' ' ' CYS . 46.8 mt -59.73 -59.08 4.49 Favored 'Isoleucine or valine' 0 C--N 1.352 0.715 0 CA-C-N 114.754 -1.112 . . . . 75.52 109.671 175.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.46 -33.48 65.95 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.176 0.59 . . . . 74.41 111.999 -178.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -60.04 -53.66 55.23 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.36 1.064 . . . . 72.13 111.258 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -77.96 -26.79 48.99 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 122.306 -0.246 . . . . 71.13 110.458 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.545 ' HG ' ' HG2' ' A' ' 145' ' ' ARG . 10.5 tp -72.7 -36.51 67.86 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.811 0.844 . . . . 75.33 110.951 -169.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.7 t -67.53 -30.67 70.38 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.664 -0.698 . . . . 74.54 110.605 175.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.25 -3.48 57.78 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.142 0.977 . . . . 51.12 110.936 177.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 t -94.39 126.68 39.81 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.095 0.958 . . . . 73.3 110.485 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -90.92 -44.45 9.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.748 0.819 . . . . 75.52 109.391 171.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -147.62 7.99 0.87 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.297 1.039 . . . . 73.23 111.333 -175.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -75.24 84.21 2.41 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 108.208 -1.034 . . . . 65.42 108.208 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.573 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 22.2 mm -63.72 146.26 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 114.696 -1.138 . . . . 73.45 108.464 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -36.99 -54.17 0.95 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 125.714 1.606 . . . . 73.23 112.232 -178.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.457 ' CZ ' HG21 ' A' ' 76' ' ' ILE . 52.9 m-85 -128.49 42.37 3.33 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 114.97 -1.014 . . . . 74.32 112.006 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.573 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 4.9 tmtm? -58.58 -61.1 2.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 119.512 1.051 . . . . 71.24 109.916 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.83 -41.03 92.29 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.287 -0.869 . . . . 73.34 111.626 -174.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.7 t -67.86 -43.63 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 123.513 0.508 . . . . 72.35 110.851 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.4 t30 -61.41 -38.88 88.72 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.563 -0.744 . . . . 74.51 110.269 174.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -31.89 72.8 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.033 0.533 . . . . 73.21 109.801 177.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.81 -56.68 10.63 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.154 0.582 . . . . 75.44 109.878 174.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.469 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.8 mp -55.3 -38.87 69.22 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.688 0.618 . . . . 74.24 111.008 178.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.2 t -73.66 -49.07 27.75 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.527 0.731 . . . . 75.01 111.888 -174.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.41 -48.59 74.83 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.44 0.696 . . . . 74.02 109.674 -177.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.1 t -64.52 -37.12 79.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 CA-C-N 114.968 -1.015 . . . . 74.52 110.516 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.414 ' HZ3' HD21 ' A' ' 42' ' ' LEU . 61.2 t-105 -60.97 -38.65 86.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.56 0.344 . . . . 75.44 111.497 176.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.0 -56.9 16.3 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.118 -0.697 . . . . 74.4 109.118 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -55.27 -44.69 75.84 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.199 0.937 . . . . 75.21 111.16 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.432 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.4 tt -69.82 -53.4 18.38 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.29 1.436 . . . . 74.43 110.796 -171.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.5 t -63.64 -36.02 82.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.371 0.668 . . . . 65.4 110.998 -179.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.54 -53.54 54.96 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.563 0.539 . . . . 72.33 111.155 176.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.408 HD11 HD23 ' A' ' 58' ' ' LEU . 3.9 pp -70.05 -24.42 63.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.089 -0.382 . . . . 72.41 111.796 -177.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.41 HD13 ' HE3' ' A' ' 122' ' ' MET . 67.3 mt -70.17 -43.14 71.45 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.297 0.239 . . . . 64.11 111.149 173.306 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.54 -23.06 40.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.509 0.559 . . . . 71.22 112.509 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.96 -50.13 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.407 0.283 . . . . 71.41 111.203 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.459 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 24.8 mm-40 -81.34 -56.76 3.84 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.924 0.392 . . . . 74.21 110.883 -176.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -86.72 -1.36 57.66 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 115.647 -0.706 . . . . 74.12 110.83 -175.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.7 mmt180 65.52 19.01 11.46 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.173 1.389 . . . . 74.42 113.331 170.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.41 ' HE3' HD13 ' A' ' 116' ' ' LEU . 50.9 mtp -70.64 143.05 89.37 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.708 0.803 . . . . 71.53 112.01 -173.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -83.15 24.98 0.71 Allowed 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.464 2.109 . . . . 74.52 113.194 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 16.9 m -75.17 115.83 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-O 121.46 0.648 . . . . 74.41 111.932 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 24.3 t -166.95 65.49 0.82 Allowed Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 114.491 -1.232 . . . . 64.03 108.265 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.429 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 42.9 Cg_endo -87.39 28.88 0.5 Allowed 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 123.526 2.818 . . . . 62.12 111.911 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 6.7 tt -146.55 152.43 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.024 1.33 . . . . 75.44 108.101 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.4 m -83.31 -158.69 0.3 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 122.95 0.5 . . . . 64.5 110.052 172.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -62.8 -37.96 88.81 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.673 0.789 . . . . 74.25 111.62 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 122.13 1.91 10.25 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-O 119.538 -0.59 . . . . 75.21 113.533 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.13 97.83 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.481 0.712 . . . . 65.51 111.603 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' SER . . . . . 0.462 ' O ' ' HG3' ' A' ' 136' ' ' GLU . 31.6 m -66.76 -39.79 88.02 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.725 -0.67 . . . . 75.34 110.179 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.8 m0 -62.79 -18.03 62.08 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.307 0.854 . . . . 73.23 113.307 -178.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.91 -41.35 19.01 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.149 0.5 . . . . 65.44 110.69 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -80.78 -23.76 39.08 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.134 0.79 . . . . 72.14 113.134 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 132' ' ' SER . 76.8 mt-10 -62.29 -53.69 51.47 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.477 0.486 . . . . 73.5 109.732 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.97 -61.82 1.86 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.95 1.406 . . . . 75.32 111.563 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.54 -41.04 93.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 123.529 0.518 . . . . 74.45 112.304 -179.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 34.1 tt0 -67.87 -63.29 1.09 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 118.035 0.379 . . . . 61.32 111.746 -175.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.584 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 2.6 p30 -73.4 -30.58 63.36 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.276 -0.392 . . . . 72.21 111.623 -171.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.405 ' HB1' HD12 ' A' ' 96' ' ' ILE . . . -77.55 -23.06 50.18 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-O 119.117 -0.468 . . . . 71.35 111.453 176.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -60.51 -51.95 67.27 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.588 -0.893 . . . . 74.52 108.588 164.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 36.9 mt-10 -59.44 -40.47 86.9 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 124.085 0.865 . . . . 73.13 111.528 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.493 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 14.2 t0 -79.75 -45.97 17.87 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.16 0.984 . . . . 72.01 110.962 -168.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.545 ' HG2' ' HG ' ' A' ' 89' ' ' LEU . 4.3 tmt_? -62.73 -42.98 99.93 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.191 0.997 . . . . 72.54 109.158 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -67.45 -34.24 76.79 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.626 -0.716 . . . . 75.13 111.027 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.25 -24.9 54.55 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.525 0.33 . . . . 75.24 111.847 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.06 -36.75 35.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.845 0.458 . . . . 74.53 110.043 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -80.51 -41.18 24.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.092 0.557 . . . . 74.23 112.042 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' MET . . . . . 0.483 ' HA ' ' HE3' ' A' ' 150' ' ' MET . 3.4 tpt -102.54 55.97 0.78 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 107.076 -1.453 . . . . 74.41 107.076 176.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 42.3 tp -82.8 87.38 6.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 114.052 -1.431 . . . . 75.53 111.156 -168.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -123.33 66.45 1.0 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.261 -1.014 . . . . 74.54 108.261 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.2 tpp85 -167.4 -49.44 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 114.344 -1.298 . . . . 74.34 109.79 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -132.05 34.17 3.84 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.575 -0.739 . . . . 73.33 110.453 -169.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -69.58 98.38 1.14 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.859 0.464 . . . . 74.25 109.888 -179.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 . . . . . 0 C--O 1.249 1.078 0 C-N-CA 125.432 1.493 . . . . 74.4 111.235 -176.071 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 112.227 0.454 . . . . 75.21 112.227 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -71.91 -26.38 62.29 Favored 'General case' 0 C--N 1.36 1.032 0 CA-C-N 118.222 0.464 . . . . 74.34 110.238 173.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -59.09 -51.51 69.73 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.789 -0.449 . . . . 73.03 109.789 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.61 -36.7 81.49 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 124.063 0.852 . . . . 71.14 111.375 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -57.53 -47.63 81.48 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 123.532 0.52 . . . . 73.33 109.784 176.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.98 -47.99 78.21 Favored 'General case' 0 C--O 1.212 -0.915 0 O-C-N 123.886 0.741 . . . . 75.23 110.977 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.13 -49.37 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 123.999 0.92 . . . . 73.33 111.313 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.3 mm -71.31 -43.81 73.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 CA-C-N 115.141 -0.936 . . . . 73.15 111.049 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -62.49 -51.19 68.43 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 122.874 0.469 . . . . 70.14 109.987 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -54.33 -46.48 72.89 Favored 'General case' 0 C--O 1.208 -1.116 0 O-C-N 124.453 1.095 . . . . 75.33 110.548 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.44 -52.95 49.77 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 124.332 1.02 . . . . 64.23 113.828 -177.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.405 ' HG3' HD13 ' A' ' 39' ' ' ILE . 27.3 mt-30 -66.25 -40.72 90.4 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 122.842 0.457 . . . . 70.03 111.2 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.44 -37.75 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.885 0.874 . . . . 73.11 110.427 174.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.5 HD13 ' O ' ' A' ' 69' ' ' LEU . 17.0 mt -59.24 -50.8 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.663 1.185 . . . . 71.53 109.804 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -56.97 -43.86 82.04 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.354 1.034 . . . . 75.2 111.286 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.69 -49.41 71.01 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.033 0.533 . . . . 73.04 112.141 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.534 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 10.4 ptm180 -81.8 -16.44 50.92 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.495 0.554 . . . . 74.12 112.495 -174.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.644 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 38.5 t -69.03 -19.84 64.12 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.515 0.726 . . . . 75.15 110.775 173.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.615 ' HA ' ' HG ' ' A' ' 28' ' ' CYS . 40.1 mt-10 -72.13 1.93 6.66 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.48 0.712 . . . . 74.34 112.154 175.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -65.95 -32.1 73.39 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.246 0.618 . . . . 61.52 111.064 165.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.46 ' SD ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -71.4 86.04 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.824 0.449 . . . . 74.1 110.897 -176.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -71.31 -47.4 56.93 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 106.7 -1.593 . . . . 72.33 106.7 170.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.426 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.8 m-85 -91.53 142.98 27.06 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.358 -1.349 . . . . 71.41 107.358 164.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' A' ' 85' ' ' ILE . 38.9 m 63.34 46.05 4.63 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 124.248 0.967 . . . . 75.01 110.247 -160.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' O ' ' HB3' ' A' ' 28' ' ' CYS . 56.9 pttt -70.07 -44.29 69.42 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.78 -1.555 . . . . 74.3 111.511 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.721 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 45.1 mtpt -74.22 -26.87 60.5 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 119.178 -0.439 . . . . 75.05 109.83 -178.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -31.22 71.83 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.649 0.593 . . . . 72.44 109.969 171.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.644 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 9.0 t -67.18 -43.63 81.72 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.638 0.775 . . . . 72.23 111.432 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -76.39 -24.84 54.09 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-O 119.84 -0.124 . . . . 73.53 111.027 176.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 4.1 tpm_? -65.09 -59.08 4.52 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.547 -0.909 . . . . 74.34 108.547 176.042 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 ' SG ' ' A' ' 18' ' ' CYS . 58.3 tp -61.5 -47.42 85.72 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 124.731 1.27 . . . . 72.13 110.615 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.59 -54.74 34.59 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 124.076 0.86 . . . . 72.41 113.67 -174.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -67.01 -32.51 73.79 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.323 0.649 . . . . 73.31 110.617 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.455 ' HB2' ' O ' ' A' ' 30' ' ' ARG . 1.7 mtt-85 -56.3 -56.93 14.97 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 123.858 0.724 . . . . 75.43 110.645 173.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 65.2 t -60.97 -43.22 95.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 CA-C-N 114.156 -1.384 . . . . 74.41 110.559 -175.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.47 -50.42 74.01 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.865 0.466 . . . . 72.44 110.939 177.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.34 -18.63 69.71 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 115.379 -0.828 . . . . 73.44 113.557 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.9 -52.56 5.92 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.771 0.828 . . . . 74.15 110.259 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.405 HD13 ' HG3' ' A' ' 12' ' ' GLN . 16.2 pt -75.89 -32.84 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 118.761 -0.638 . . . . 75.42 111.977 -167.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.467 ' O ' ' HG2' ' A' ' 44' ' ' MET . 92.7 mttt -58.15 -49.56 92.91 Favored Pre-proline 0 CA--C 1.561 1.401 0 CA-C-O 117.609 -1.186 . . . . 72.14 112.506 -178.199 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -45.65 -43.37 18.53 Favored 'Trans proline' 0 C--N 1.401 3.306 0 C-N-CA 122.932 2.421 . . . . 73.23 113.485 169.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -71.05 -38.72 72.53 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.653 0.381 . . . . 73.34 111.19 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 47.7 mt-10 -67.42 -20.89 65.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.794 0.438 . . . . 75.13 111.085 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.467 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 28.3 mmt -68.55 -55.8 10.46 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 110.008 -0.367 . . . . 74.55 110.008 173.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.648 HD21 ' SD ' ' A' ' 122' ' ' MET . 2.6 pp -70.25 -21.49 62.98 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 111.623 0.231 . . . . 74.25 111.623 179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.435 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.3 tm0? -80.44 -33.33 36.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.014 0.926 . . . . 44.52 110.35 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.55 -42.92 70.52 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.597 -0.52 . . . . 72.01 109.597 178.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.89 2.62 25.81 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.258 -0.883 . . . . 74.13 110.571 170.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.31 95.86 0.07 OUTLIER Glycine 0 C--N 1.351 1.377 0 C-N-CA 124.35 0.976 . . . . 73.32 113.312 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -146.34 141.77 27.59 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 125.141 1.377 . . . . 73.23 107.455 172.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 64.23 96.81 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.547 1.139 . . . . 74.04 109.955 -171.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 9.9 m -72.77 148.92 44.12 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.151 0.58 . . . . 72.23 111.134 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.6 p -147.79 63.36 7.59 Favored Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.569 0.748 . . . . 72.41 109.089 172.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.446 ' HA ' HD21 ' A' ' 58' ' ' LEU . 95.6 Cg_endo -84.51 88.86 0.96 Allowed 'Trans proline' 0 C--N 1.38 2.196 0 C-N-CA 121.74 1.626 . . . . 71.41 110.651 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.4 p -64.85 163.34 14.47 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.175 -0.921 . . . . 62.41 109.833 175.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -52.8 -46.53 67.69 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.439 0.696 . . . . 74.01 112.549 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -64.07 -39.49 94.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.737 0.815 . . . . 73.04 111.568 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.446 HD21 ' HA ' ' A' ' 54' ' ' PRO . 41.1 tp -73.97 -35.55 64.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.11 0.964 . . . . 74.22 110.423 -175.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 m -66.54 -49.69 65.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.942 0.897 . . . . 65.34 109.077 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.438 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 32.3 m -61.04 -38.31 85.69 Favored 'General case' 0 C--N 1.356 0.862 0 O-C-N 124.06 0.85 . . . . 73.01 110.482 178.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.454 ' HB2' HD12 ' A' ' 112' ' ' LEU . . . -65.4 -45.65 83.15 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 123.565 0.746 . . . . 74.02 110.611 -179.491 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.3 mmt -70.17 -24.96 63.23 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 123.821 0.701 . . . . 74.22 111.666 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -71.79 -46.23 58.98 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.218 0.607 . . . . 73.3 110.173 174.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.3 mtt180 -62.44 -38.25 89.02 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.753 0.821 . . . . 73.11 110.311 175.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.1 t80 -63.32 -59.71 4.35 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 113.704 -1.589 . . . . 74.42 109.192 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.429 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 25.2 ttpp -56.17 -44.12 79.04 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 124.561 1.163 . . . . 74.14 110.697 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.28 82.65 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 124.258 0.974 . . . . 73.4 112.142 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.473 ' HB2' HD13 ' A' ' 105' ' ' LEU . . . -68.86 -39.19 79.99 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.511 0.725 . . . . 72.23 111.418 178.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.5 ' O ' HD13 ' A' ' 14' ' ' ILE . 4.2 mm? -68.53 -31.18 70.24 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.713 0.805 . . . . 73.44 111.131 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.429 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 55.3 mt-10 -67.44 -43.42 81.19 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.646 -0.501 . . . . 75.52 109.646 174.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.72 -38.97 92.81 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.127 -0.942 . . . . 75.25 111.06 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.13 -44.96 86.97 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.413 0.685 . . . . 61.2 110.578 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -59.8 -41.6 91.56 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 124.328 1.017 . . . . 73.31 110.658 176.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.87 -37.09 91.99 Favored Glycine 0 C--N 1.35 1.307 0 CA-C-N 115.438 -0.801 . . . . 73.1 113.107 177.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.58 -52.2 62.04 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 122.832 0.453 . . . . 75.4 110.458 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.44 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -70.61 -20.0 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 N-CA-C 112.616 0.598 . . . . 74.54 112.616 178.982 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.534 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 3.3 tm-20 -67.32 -43.37 81.8 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.344 -0.613 . . . . 75.4 109.344 170.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -69.38 -40.87 77.17 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.973 0.909 . . . . 73.43 111.416 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 13.9 m-85 -80.8 0.34 35.28 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.078 0.951 . . . . 74.41 112.511 -173.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -56.43 -32.29 64.76 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.368 0.604 . . . . 74.34 109.859 174.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -82.62 112.23 19.31 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 114.858 -1.065 . . . . 72.25 109.441 168.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.411 ' HB3' ' HB2' ' A' ' 23' ' ' TYR . 2.9 mpt_? -74.9 -24.35 58.52 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.775 0.83 . . . . 73.03 110.566 -177.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -67.48 -37.55 83.05 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.078 0.951 . . . . 64.12 111.076 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.55 -46.22 89.51 Favored 'General case' 0 C--O 1.255 1.37 0 C-N-CA 124.098 0.959 . . . . 71.0 110.076 173.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.574 HG21 HD11 ' A' ' 97' ' ' LEU . 34.2 mt -58.31 -56.29 17.08 Favored 'Isoleucine or valine' 0 C--N 1.358 0.942 0 CA-C-N 114.573 -1.194 . . . . 71.0 109.956 177.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.3 t -53.91 -39.92 66.24 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.675 1.19 . . . . 74.21 111.612 -176.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -61.04 -54.1 48.94 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 124.544 1.153 . . . . 75.05 111.026 179.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -22.86 53.42 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 116.306 -0.407 . . . . 71.42 111.051 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.1 tp -80.75 -33.77 34.82 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.099 0.96 . . . . 73.5 110.888 -172.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.7 t -72.75 -20.22 61.23 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 121.125 0.488 . . . . 70.04 109.992 172.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.34 8.9 43.67 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.48 1.112 . . . . 75.14 111.244 174.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.752 ' HB3' ' HB3' ' A' ' 95' ' ' LYS . 67.6 m -151.26 90.53 1.6 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.612 1.165 . . . . 73.42 109.466 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -77.99 -47.33 18.74 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.715 0.635 . . . . 74.52 112.715 -165.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.09 -22.05 15.35 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.711 -0.477 . . . . 72.14 109.711 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.752 ' HB3' ' HB3' ' A' ' 92' ' ' SER . 36.5 ttmt -58.48 117.68 4.76 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 124.678 1.236 . . . . 74.54 111.046 -173.422 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.99 143.22 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.657 -1.156 . . . . 75.32 108.217 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.574 HD11 HG21 ' A' ' 85' ' ' ILE . 4.5 tp -58.13 -30.51 66.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.928 0.714 . . . . 72.34 112.928 -168.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -119.63 17.88 12.76 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-O 118.159 -0.924 . . . . 74.33 110.645 -176.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.62 ' HG2' ' HG3' ' A' ' 95' ' ' LYS . 0.0 OUTLIER -36.3 -53.32 0.83 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 115.024 1.491 . . . . 75.41 115.024 -160.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . 0.462 ' N ' ' HD3' ' A' ' 99' ' ' LYS . 30.6 m-20 -71.3 -50.75 29.34 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 118.648 0.658 . . . . 73.14 111.564 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.92 -52.82 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 123.944 0.898 . . . . 73.44 111.18 -176.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -63.78 -36.88 85.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.334 1.054 . . . . 75.34 110.998 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -62.71 -32.26 73.33 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.197 0.599 . . . . 64.14 110.717 172.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 98.9 mttt -70.99 -39.74 72.27 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 119.348 -0.358 . . . . 73.11 110.214 174.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 68' ' ' ALA . 10.4 mp -58.2 -44.61 88.18 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.603 -0.517 . . . . 73.54 109.603 172.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.4 m -63.11 -50.42 70.57 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.015 0.926 . . . . 71.42 111.347 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 37.6 t70 -73.56 -44.05 58.35 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 115.128 -0.942 . . . . 74.44 111.184 -171.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.505 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 93.8 t -64.06 -36.48 77.0 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 118.843 -0.598 . . . . 73.5 109.416 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -64.21 -44.71 91.08 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 119.088 -0.482 . . . . 74.14 112.055 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.409 ' HA ' ' HB2' ' A' ' 129' ' ' GLN . 8.5 ptmm? -64.78 -44.31 90.42 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 118.568 0.622 . . . . 63.22 110.378 177.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 11.9 mm-40 -60.8 -41.04 94.86 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.044 0.449 . . . . 61.4 111.076 176.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.6 tp -61.57 -59.96 4.42 Favored 'General case' 0 C--O 1.215 -0.726 0 C-N-CA 124.633 1.173 . . . . 73.45 107.941 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.511 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 33.0 t -55.82 -41.22 73.88 Favored 'General case' 0 C--N 1.35 0.601 0 O-C-N 124.557 1.16 . . . . 70.52 111.402 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 81.0 mt -57.7 -54.88 41.87 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.886 0.741 . . . . 71.33 111.481 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.21 -23.74 63.93 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 122.497 -0.127 . . . . 71.35 111.185 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.604 HD12 ' SD ' ' A' ' 122' ' ' MET . 95.8 mt -73.86 -28.38 61.55 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.769 0.828 . . . . 74.42 111.038 174.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.511 ' HG2' ' O ' ' A' ' 113' ' ' SER . 27.6 mm-40 -71.94 -43.67 64.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.025 0.53 . . . . 74.42 109.639 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.84 -50.07 26.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 116.036 -0.529 . . . . 64.32 112.046 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . 0.402 ' HB2' ' OE1' ' A' ' 120' ' ' GLN . 8.6 mm-40 -82.61 -57.61 3.26 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 111.936 0.347 . . . . 75.3 111.936 -171.439 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.402 ' OE1' ' HB2' ' A' ' 119' ' ' GLU . 24.5 mp0 -89.14 -29.85 19.04 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.519 0.328 . . . . 73.23 111.559 -176.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 56.39 61.84 2.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.465 1.106 . . . . 71.12 110.92 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.648 ' SD ' HD21 ' A' ' 45' ' ' LEU . 22.4 ptm -91.32 147.17 34.88 Favored Pre-proline 0 N--CA 1.476 0.843 0 CA-C-N 114.569 -1.196 . . . . 73.31 108.109 172.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -60.82 -63.2 0.11 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.225 1.95 . . . . 75.41 113.264 -174.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.447 HG22 ' HG3' ' A' ' 122' ' ' MET . 16.2 t 59.24 48.58 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 CA-C-O 122.52 1.152 . . . . 71.11 109.394 -171.672 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -67.04 -49.99 43.83 Favored Pre-proline 0 CA--C 1.569 1.691 0 CA-C-N 114.747 -1.115 . . . . 74.34 113.966 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -75.51 7.76 2.92 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 122.017 1.812 . . . . 70.12 114.771 -167.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 15.2 tt -155.96 -27.58 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 N-CA-C 112.966 0.728 . . . . 74.12 112.966 -172.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t 70.64 -74.28 0.09 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.475 1.11 . . . . 73.52 111.2 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 110' ' ' LYS . 0.8 OUTLIER -162.82 18.92 0.08 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.019 0.928 . . . . 74.51 110.665 176.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 90.33 49.51 3.23 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 115.765 -0.652 . . . . 74.23 112.513 -175.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -71.79 -54.21 10.9 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.26 0.624 . . . . 72.22 110.393 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.3 m -62.59 -33.03 74.14 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.052 -0.976 . . . . 74.44 111.561 178.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 27.4 m0 -52.02 -48.49 64.48 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.966 1.306 . . . . 71.22 113.141 -176.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.43 -27.89 40.17 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.056 0.762 . . . . 71.11 113.056 -174.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -88.13 -43.25 11.8 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.121 0.569 . . . . 73.14 110.638 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.401 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 45.3 mt-10 -59.59 -34.69 73.06 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.2 1.0 . . . . 73.3 112.778 -177.076 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.401 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 55.8 m-20 -61.25 -64.39 0.97 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.338 0.655 . . . . 73.21 109.885 -176.169 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -61.45 -43.98 97.91 Favored 'General case' 0 C--O 1.213 -0.824 0 O-C-N 124.059 0.849 . . . . 64.45 110.864 -178.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.9 tm0? -64.88 -60.22 3.32 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.399 0.68 . . . . 73.41 110.878 -171.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -67.46 -43.91 79.92 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-N 114.906 -1.043 . . . . 71.41 111.023 -173.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.88 -32.35 72.78 Favored 'General case' 0 C--N 1.358 0.955 0 CA-C-N 116.103 -0.499 . . . . 43.53 111.945 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.468 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 31.2 t70 -65.8 -47.63 74.45 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.541 0.526 . . . . 71.14 110.569 176.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -58.51 -41.41 85.34 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 124.108 0.88 . . . . 73.42 111.18 177.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.4 t0 -64.96 -42.81 94.26 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.762 0.825 . . . . 64.41 111.724 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -62.36 -37.56 86.15 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.331 -0.849 . . . . 75.42 109.743 175.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 97.9 mtt180 -62.63 -43.07 99.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.837 0.455 . . . . 75.04 109.926 174.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.61 -22.13 62.57 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.018 0.824 . . . . 73.41 111.91 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.426 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.2 OUTLIER -81.72 -55.64 4.51 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 122.981 0.512 . . . . 75.54 110.022 176.086 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -69.32 -61.38 1.81 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.524 -0.762 . . . . 75.23 110.026 -175.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.3 ttm -86.06 72.14 10.47 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.269 -1.382 . . . . 74.5 107.269 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp -73.74 88.8 1.76 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.373 -0.831 . . . . 73.13 109.668 -178.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -110.01 60.47 0.6 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.36 -0.978 . . . . 75.24 108.36 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -159.83 -47.77 0.05 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 114.539 -1.21 . . . . 75.43 109.552 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -118.76 164.41 15.42 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.527 0.731 . . . . 72.34 109.77 -176.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -153.83 80.62 1.15 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 107.925 -1.139 . . . . 74.2 107.925 175.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.25 1.121 0 C-N-CA 124.159 0.984 . . . . 72.42 109.473 -175.08 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.3 ttp . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 118.315 -0.85 . . . . 71.12 111.748 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -42.49 -56.71 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 113.836 1.05 . . . . 74.0 113.836 -167.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -61.33 -40.0 92.6 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.821 0.448 . . . . 74.2 112.08 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.554 HD21 HD13 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -68.8 -38.18 79.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.284 0.564 . . . . 72.11 109.66 -177.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -68.61 -34.48 75.85 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.081 0.952 . . . . 73.45 108.932 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -66.31 -37.94 86.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.93 0.492 . . . . 74.3 110.426 177.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 85.9 mt -57.21 -50.59 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.781 0.832 . . . . 74.13 110.52 171.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.581 HG23 ' HG2' ' A' ' 43' ' ' GLU . 19.5 mm -63.25 -42.85 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 115.668 -0.696 . . . . 72.04 111.305 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -63.53 -51.79 63.97 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 123.848 0.859 . . . . 74.45 110.471 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.438 HD12 ' HE2' ' A' ' 66' ' ' LYS . 82.4 mt -59.22 -53.0 63.28 Favored 'General case' 0 C--O 1.216 -0.699 0 O-C-N 124.04 0.838 . . . . 73.1 110.49 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.443 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.53 -38.62 88.26 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 124.64 1.212 . . . . 73.23 113.9 -177.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -74.4 -43.68 55.3 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 122.536 -0.39 . . . . 74.53 110.666 -179.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.84 -24.32 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.546 0.339 . . . . 74.32 110.353 175.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.487 HG23 HG23 ' A' ' 35' ' ' VAL . 51.3 mt -64.43 -52.9 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.729 0.812 . . . . 72.3 108.913 171.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -54.34 -36.8 64.19 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 124.234 0.959 . . . . 73.42 111.25 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -72.04 -66.0 0.7 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.828 0.851 . . . . 75.51 111.34 178.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.432 ' HD2' HG13 ' A' ' 76' ' ' ILE . 9.7 ptp180 -68.34 -19.31 64.64 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.732 0.813 . . . . 75.3 112.564 -170.586 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.9 t -64.59 -29.85 70.87 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.751 0.42 . . . . 71.53 110.874 176.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.44 -6.43 24.74 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.522 0.564 . . . . 74.44 112.522 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.81 -28.43 69.86 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 119.424 -0.322 . . . . 74.51 110.797 169.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.502 ' HE3' HG22 ' A' ' 76' ' ' ILE . 3.2 mmt -65.66 94.57 0.2 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.982 -0.748 . . . . 72.32 108.982 176.41 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -72.88 -26.69 61.53 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.816 0.817 . . . . 74.51 110.123 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 92.7 m-85 -93.88 -174.25 3.38 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.413 -1.721 . . . . 74.25 109.265 166.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.466 ' SG ' HG21 ' A' ' 85' ' ' ILE . 56.8 m 54.32 53.9 10.24 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.814 0.845 . . . . 73.22 112.8 174.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.0 -52.45 65.48 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.963 0.905 . . . . 73.33 112.14 -175.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.527 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 19.3 tptm -68.19 -47.83 66.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.279 -0.873 . . . . 75.15 110.993 -173.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.474 ' HA ' ' HB3' ' A' ' 30' ' ' ARG . 19.1 mt-30 -73.02 -25.48 60.97 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.788 0.662 . . . . 75.2 112.788 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.528 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 42.4 t -71.19 -49.44 43.67 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.99 0.516 . . . . 75.1 110.271 176.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -73.35 -22.0 60.4 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.425 -0.807 . . . . 74.42 111.053 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.799 HH12 ' HB2' ' A' ' 98' ' ' PHE . 19.1 ttt-85 -63.12 -52.93 60.6 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.314 1.046 . . . . 75.54 110.043 169.449 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.87 -49.42 77.82 Favored 'General case' 0 C--N 1.359 1.011 0 O-C-N 123.843 0.714 . . . . 74.14 109.705 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.14 96.6 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 124.301 1.001 . . . . 63.2 112.895 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -63.12 -49.12 75.68 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.879 0.872 . . . . 73.42 111.019 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.471 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 84.1 mtt-85 -61.56 -56.37 20.72 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.053 0.846 . . . . 73.04 110.716 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.487 HG23 HG23 ' A' ' 14' ' ' ILE . 58.6 t -56.23 -46.44 81.38 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 O-C-N 124.296 0.997 . . . . 73.31 111.407 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.495 HD22 HD13 ' A' ' 39' ' ' ILE . 72.3 mt -62.77 -40.98 98.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 123.443 0.465 . . . . 73.33 111.25 177.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.29 -27.56 71.78 Favored Glycine 0 CA--C 1.532 1.114 0 O-C-N 123.379 0.425 . . . . 75.42 112.951 177.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.57 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 47.9 mt -84.52 -47.75 10.28 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.305 0.642 . . . . 74.35 111.481 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.495 HD13 HD22 ' A' ' 36' ' ' LEU . 22.4 pt -76.83 -40.28 31.64 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.357 0 CA-C-O 117.807 -1.092 . . . . 73.53 111.409 -171.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -54.39 -47.79 96.61 Favored Pre-proline 0 N--CA 1.493 1.675 0 N-CA-C 113.553 0.946 . . . . 75.15 113.553 -169.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.38 -48.01 23.81 Favored 'Trans proline' 0 C--N 1.401 3.315 0 C-N-CA 122.003 1.802 . . . . 73.33 111.395 171.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.554 HD13 HD21 ' A' ' 4' ' ' LEU . 4.3 mm? -69.89 -25.23 63.6 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 124.087 0.867 . . . . 73.41 111.474 -177.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.581 ' HG2' HG23 ' A' ' 8' ' ' ILE . 43.4 mt-10 -67.22 -52.08 45.49 Favored 'General case' 0 C--N 1.354 0.783 0 N-CA-C 108.544 -0.91 . . . . 73.22 108.544 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 70.6 mtm -57.63 -45.85 84.9 Favored 'General case' 0 C--N 1.351 0.668 0 O-C-N 124.211 0.944 . . . . 74.21 110.306 177.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.4 HD12 ' HE3' ' A' ' 122' ' ' MET . 79.9 mt -71.62 -21.57 61.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.732 0.813 . . . . 65.31 112.607 -178.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.65 -53.11 7.95 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.581 0.753 . . . . 72.4 109.807 178.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -67.06 -38.89 86.62 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.681 0.613 . . . . 54.14 111.361 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -71.84 -32.79 67.87 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.112 0.565 . . . . 75.35 110.627 174.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -88.51 66.53 3.18 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.871 -0.492 . . . . 73.21 111.871 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -63.01 -35.93 81.86 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.721 0.808 . . . . 74.24 110.398 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.49 138.03 52.08 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.063 -0.717 . . . . 74.02 109.063 170.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.9 m -151.86 168.5 24.92 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.841 1.256 . . . . 70.23 108.56 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.5 t -105.54 98.32 16.88 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 108.86 -0.793 . . . . 74.04 108.86 171.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.564 ' HA ' HD23 ' A' ' 58' ' ' LEU . 6.1 Cg_exo -73.93 95.26 0.89 Allowed 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.218 1.946 . . . . 74.54 110.027 174.406 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -62.3 160.8 12.5 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.826 -0.625 . . . . 74.12 109.91 175.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -59.94 -50.7 72.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.967 0.507 . . . . 75.34 110.741 -175.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.84 67.13 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.637 -0.71 . . . . 71.23 112.051 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.564 HD23 ' HA ' ' A' ' 54' ' ' PRO . 33.4 tp -66.72 -48.89 67.77 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.903 0.481 . . . . 74.34 110.047 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.8 m -60.52 -43.36 97.18 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 124.189 0.931 . . . . 74.41 110.136 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -56.46 -47.65 78.71 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 123.793 0.683 . . . . 74.34 110.959 176.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.44 98.77 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.373 0.669 . . . . 72.44 111.439 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.471 ' SD ' HD12 ' A' ' 112' ' ' LEU . 23.1 mmt -64.71 -34.09 77.49 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.292 0.637 . . . . 75.43 111.266 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -73.72 -35.29 65.09 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.218 0.607 . . . . 71.35 110.653 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -66.06 -39.58 90.21 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.688 0.795 . . . . 65.4 110.27 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.57 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 3.3 t80 -70.76 -42.45 70.43 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.188 0.995 . . . . 73.21 110.234 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.438 ' HE2' HD12 ' A' ' 10' ' ' LEU . 14.7 tmtt? -64.72 -38.92 92.63 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.48 1.112 . . . . 75.2 110.053 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.8 -40.6 92.05 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.381 0.673 . . . . 74.32 111.009 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.67 80.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.385 0.674 . . . . 73.23 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -72.09 -26.09 62.01 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.786 -0.643 . . . . 75.1 111.067 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.72 -34.37 71.84 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.906 0.482 . . . . 75.33 110.351 172.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.487 ' HB3' HG23 ' A' ' 101' ' ' VAL . 25.3 mm-40 -64.13 -44.46 92.14 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.985 -0.552 . . . . 65.12 110.878 175.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -63.29 -59.72 4.34 Favored 'General case' 0 C--N 1.354 0.796 0 O-C-N 123.454 0.471 . . . . 62.21 110.555 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -47.64 -46.35 28.8 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.019 1.728 . . . . 74.1 111.875 -176.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.2 -44.05 87.59 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.471 1.107 . . . . 73.23 113.416 -176.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.468 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . 25.4 mt-10 -67.06 -48.36 68.49 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 118.294 -0.86 . . . . 74.55 111.028 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.617 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.8 pt -66.37 -26.77 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 CA-C-N 118.704 0.684 . . . . 75.31 111.678 176.519 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -60.77 -40.96 94.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.11 0.564 . . . . 72.04 110.232 171.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -85.39 -22.65 28.29 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.874 0.694 . . . . 74.24 112.874 175.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.617 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.2 m-85 -79.33 -1.63 37.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.549 0.74 . . . . 71.35 111.68 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.4 p -56.74 -26.33 56.91 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.424 0.689 . . . . 75.34 110.775 172.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -82.73 112.4 19.55 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 107.548 -1.278 . . . . 75.32 107.548 162.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.431 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.7 mpt_? -70.78 -23.69 62.44 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.069 0.548 . . . . 63.53 110.821 -175.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 25.5 m -63.73 -33.97 76.85 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.158 0.983 . . . . 61.01 111.66 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -57.09 -45.82 83.04 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.157 0.983 . . . . 51.53 110.075 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.499 HD11 ' SD ' ' A' ' 21' ' ' MET . 21.1 mt -60.79 -54.82 29.99 Favored 'Isoleucine or valine' 0 C--N 1.352 0.694 0 O-C-N 124.248 0.967 . . . . 75.34 109.869 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 27.5 t -57.18 -38.03 73.01 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.585 0.553 . . . . 74.31 111.678 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -63.18 -47.93 80.53 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 124.184 0.927 . . . . 74.53 111.243 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.95 -29.88 50.09 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 110.096 -0.335 . . . . 73.42 110.096 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.455 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 11.7 tp -69.04 -39.05 79.42 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.934 0.894 . . . . 73.13 110.254 -172.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -78.01 -27.59 48.97 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.346 0.659 . . . . 53.12 110.84 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.72 -55.39 4.86 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.519 0.728 . . . . 74.14 111.189 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.2 t -85.2 130.5 34.59 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 108.834 -0.802 . . . . 75.41 108.834 175.1 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -92.86 -11.94 32.28 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.504 0.722 . . . . 73.04 112.4 -170.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -146.73 4.46 0.87 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.32 0.859 . . . . 74.32 113.32 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -72.63 102.24 3.24 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 107.719 -1.215 . . . . 75.2 107.719 169.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.467 HG23 ' HB1' ' A' ' 141' ' ' ALA . 3.3 mm -58.23 146.77 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 106.531 -1.655 . . . . 75.43 106.531 168.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -39.9 -48.25 2.29 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.158 0.983 . . . . 75.34 111.925 -173.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.799 ' HB2' HH12 ' A' ' 30' ' ' ARG . 72.7 m-85 -128.42 47.44 2.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.06 0.944 . . . . 70.45 111.256 176.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.1 -62.13 1.85 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 124.418 1.087 . . . . 71.32 111.571 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.07 -42.55 96.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.174 -1.375 . . . . 71.15 110.76 -175.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.487 HG23 ' HB3' ' A' ' 71' ' ' GLU . 61.3 t -63.21 -41.72 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 114.829 -1.078 . . . . 74.51 111.498 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -71.65 -32.94 68.47 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.351 0.66 . . . . 71.5 110.578 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -63.4 -41.38 98.75 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 108.904 -0.776 . . . . 73.13 108.904 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 60.3 mttm -63.37 -49.1 75.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.575 -0.739 . . . . 74.31 110.683 174.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.81 -42.21 97.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.938 0.895 . . . . 74.42 111.22 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.461 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 37.4 t -71.12 -47.79 55.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.054 0.846 . . . . 54.12 110.198 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.562 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 27.3 t70 -57.82 -57.2 13.81 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 124.051 0.844 . . . . 71.22 110.381 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.1 -38.59 82.85 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 CA-C-N 114.945 -1.025 . . . . 63.21 111.272 -178.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -60.46 -42.06 95.42 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.189 0.45 . . . . 74.11 111.221 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtmt -58.91 -57.0 15.01 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 109.665 -0.494 . . . . 75.2 109.665 174.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.66 -44.56 69.76 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.569 0.748 . . . . 74.45 111.784 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.471 HD12 ' SD ' ' A' ' 62' ' ' MET . 9.1 tt -70.21 -55.94 8.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.292 1.437 . . . . 64.04 109.885 -172.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.0 t -61.87 -31.64 71.92 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.836 0.855 . . . . 75.41 111.326 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 51.5 mt -70.24 -51.16 32.83 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 122.963 0.505 . . . . 71.25 111.031 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.87 -24.3 65.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.047 0.385 . . . . 74.43 110.497 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.64 HD22 ' SD ' ' A' ' 122' ' ' MET . 42.2 mt -64.53 -55.51 20.13 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 119.239 -0.41 . . . . 73.53 110.415 172.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -68.77 -32.8 72.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.438 0.533 . . . . 74.02 112.438 -174.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.9 -60.92 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.131 0.572 . . . . 75.24 110.802 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -84.21 -55.93 3.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.251 0.62 . . . . 74.32 111.748 -169.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.46 HE21 ' HA ' ' A' ' 116' ' ' LEU . 2.4 mp0 -82.86 -5.36 58.95 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 122.575 0.35 . . . . 72.23 111.723 -178.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 62.74 25.33 15.05 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.803 1.241 . . . . 75.25 112.344 172.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.64 ' SD ' HD22 ' A' ' 116' ' ' LEU . 69.4 mtp -84.81 126.31 68.66 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.239 1.016 . . . . 75.4 109.998 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -80.0 59.12 7.3 Favored 'Trans proline' 0 C--N 1.374 1.915 0 C-N-CA 123.086 2.524 . . . . 73.44 113.44 -172.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.22 117.73 50.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.99 0.916 . . . . 74.12 109.814 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.5 t -165.94 52.76 0.27 Allowed Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.974 1.31 . . . . 74.34 108.551 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.25 -3.75 13.29 Favored 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 122.143 1.895 . . . . 74.21 112.605 -172.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 15.1 tt -122.89 131.12 73.86 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 C-N-CA 124.125 0.97 . . . . 72.24 108.549 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 26.8 t -87.27 86.48 7.27 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.702 -0.851 . . . . 74.41 108.702 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 75.09 -67.85 0.23 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.42 1.488 . . . . 74.2 112.677 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 112.3 25.01 4.86 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-O 120.196 -0.224 . . . . 54.14 113.353 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.37 -31.44 63.93 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.296 0.638 . . . . 74.24 110.508 176.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 33.7 m -65.61 -31.28 72.22 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.803 0.841 . . . . 75.53 111.159 173.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -18.38 64.92 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.451 1.1 . . . . 73.22 112.381 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.3 67.39 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.927 0.491 . . . . 62.5 110.669 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -69.27 -31.22 69.6 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.829 -0.623 . . . . 75.21 111.046 -177.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -55.72 -58.56 7.31 Favored 'General case' 0 C--O 1.211 -0.974 0 O-C-N 124.062 0.851 . . . . 62.44 110.407 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.63 -42.51 75.06 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.926 1.084 . . . . 75.4 113.926 -173.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.104 0.253 . . . . 75.44 110.857 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . 0.421 HE21 ' HG3' ' A' ' 143' ' ' GLU . 22.6 tp60 -70.96 -35.43 72.16 Favored 'General case' 0 C--N 1.359 1.0 0 O-C-N 123.099 0.249 . . . . 74.54 110.928 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -64.63 -56.42 13.94 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.986 -0.746 . . . . 61.24 108.986 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.467 ' HB1' HG23 ' A' ' 96' ' ' ILE . . . -58.11 -36.8 73.42 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 124.399 1.062 . . . . 74.43 111.95 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -56.93 -64.09 0.99 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 122.868 0.467 . . . . 73.43 110.155 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.421 ' HG3' HE21 ' A' ' 139' ' ' GLN . 45.5 mt-10 -63.69 -38.41 91.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.979 0.912 . . . . 75.43 111.922 -174.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 18.2 t0 -86.01 -45.19 11.68 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.385 -0.825 . . . . 73.51 111.942 -165.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.455 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 54.4 ttt-85 -65.45 -36.68 84.64 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.406 -0.59 . . . . 64.23 109.406 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 38.5 ttt180 -63.58 -44.45 94.02 Favored 'General case' 0 C--N 1.356 0.887 0 CA-C-N 116.013 -0.539 . . . . 74.32 110.514 173.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . 0.576 ' HB2' ' HE ' ' A' ' 153' ' ' ARG . . . -72.36 -19.53 61.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.261 0.624 . . . . 73.3 112.576 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.434 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.7 OUTLIER -78.21 -60.47 2.36 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 109.138 -0.69 . . . . 64.14 109.138 176.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -70.39 -26.01 63.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.06 -0.973 . . . . 73.23 110.891 -173.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 41.9 ttp -117.31 56.85 0.81 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 107.388 -1.338 . . . . 73.13 107.388 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 59.9 tp -65.79 113.72 4.53 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.512 -0.767 . . . . 74.2 109.452 174.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -164.41 -76.24 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.347 -1.353 . . . . 72.3 107.347 -174.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.576 ' HE ' ' HB2' ' A' ' 147' ' ' ALA . 1.7 mpt_? 55.22 -85.8 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.301 1.04 . . . . 74.31 110.332 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -120.35 -43.45 2.51 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.081 -1.081 . . . . 75.44 108.081 170.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.3 t30 67.06 140.18 0.03 OUTLIER 'General case' 0 C--N 1.365 1.267 0 C-N-CA 125.682 1.593 . . . . 72.54 111.639 178.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 . . . . . 0 CA--C 1.551 1.015 0 N-CA-C 108.034 -1.098 . . . . 73.53 108.034 172.166 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.515 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 108.421 -0.955 . . . . 51.04 108.421 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -71.18 -43.27 67.79 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.715 -0.675 . . . . 74.14 110.339 -175.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -57.3 -51.16 70.51 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 109.432 -0.581 . . . . 73.32 109.432 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 4.3 mm? -56.37 -39.82 73.55 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.785 0.834 . . . . 72.54 111.247 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.52 -51.32 69.1 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.462 -0.94 . . . . 75.43 108.462 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -59.37 -52.75 64.27 Favored 'General case' 0 C--O 1.215 -0.725 0 O-C-N 123.788 0.68 . . . . 70.31 110.71 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.407 HG21 HD13 ' A' ' 8' ' ' ILE . 97.7 mt -52.92 -55.01 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.397 1.479 . . . . 73.24 112.365 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.426 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -67.67 -36.88 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 124.046 0.938 . . . . 74.25 110.959 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.6 m -65.75 -46.03 80.36 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.343 0.657 . . . . 62.43 110.411 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.79 -44.44 86.27 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 123.72 0.808 . . . . 73.23 109.736 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.459 ' HA3' HG23 ' A' ' 39' ' ' ILE . . . -60.29 -53.4 45.94 Favored Glycine 0 C--N 1.347 1.164 0 O-C-N 124.251 0.969 . . . . 73.03 113.052 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HG3' HD12 ' A' ' 39' ' ' ILE . 33.5 mt-30 -66.41 -31.95 73.03 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 112.033 0.383 . . . . 74.1 112.033 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -70.36 -36.92 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.331 0.653 . . . . 74.41 110.723 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.3 mt -58.77 -49.24 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.641 0.776 . . . . 74.51 109.056 175.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -56.47 -52.9 62.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.695 -1.139 . . . . 74.32 111.343 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -60.7 -57.61 11.95 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 123.799 0.687 . . . . 73.11 111.053 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -73.58 -17.19 61.21 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 112.683 0.623 . . . . 75.12 112.683 -173.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 45.7 t -60.41 -17.11 41.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.147 0.579 . . . . 71.21 111.578 170.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -55.13 -23.38 20.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.514 0.726 . . . . 74.45 112.175 172.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -66.02 -15.6 63.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.456 0.702 . . . . 64.13 112.036 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.0 mmt -78.14 82.69 4.46 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.858 -0.793 . . . . 75.03 108.858 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -35.45 73.9 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.781 -1.192 . . . . 74.21 107.781 173.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -97.03 177.16 5.7 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.656 -1.156 . . . . 75.1 109.569 165.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.569 ' HG ' HG23 ' A' ' 85' ' ' ILE . 70.9 m 54.53 58.11 5.18 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.772 0.796 . . . . 74.15 109.835 -173.175 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -70.1 -49.83 46.9 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-N 114.255 -1.339 . . . . 75.4 110.872 -169.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.538 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 24.0 mmtp -61.1 -46.61 89.91 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 108.495 -0.928 . . . . 75.1 108.495 177.27 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -36.09 71.43 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.343 1.027 . . . . 72.22 113.441 179.594 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 40.7 t -70.9 -42.32 70.1 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.405 0.44 . . . . 75.11 110.667 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -71.71 -28.3 63.6 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 115.71 -0.677 . . . . 73.32 110.945 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.687 ' HD2' ' HB3' ' A' ' 136' ' ' GLU . 33.7 ttp180 -82.6 -38.05 24.15 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.489 1.116 . . . . 73.44 109.788 -173.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.2 tp -65.75 -43.39 89.08 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.178 -1.045 . . . . 74.24 108.178 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.93 -35.36 90.37 Favored Glycine 0 C--N 1.351 1.398 0 O-C-N 123.753 0.658 . . . . 63.43 112.745 173.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -64.78 -51.52 61.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.344 0.658 . . . . 74.53 110.742 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.1 mtt-85 -57.6 -59.49 5.11 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.609 -1.178 . . . . 74.11 110.155 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.6 t -58.86 -52.38 61.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 124.668 1.23 . . . . 73.35 112.05 -174.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.28 -45.87 82.69 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 118.046 0.384 . . . . 73.34 110.349 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.41 -24.49 65.79 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 123.258 0.349 . . . . 70.54 113.494 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.451 ' O ' HD23 ' A' ' 42' ' ' LEU . 11.4 tp -86.84 -40.15 15.18 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.577 1.151 . . . . 70.52 112.071 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.459 HG23 ' HA3' ' A' ' 11' ' ' GLY . 15.6 pt -84.6 -33.76 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-O 119.275 -0.393 . . . . 74.03 111.792 -171.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -54.3 -53.76 55.6 Favored Pre-proline 0 N--CA 1.49 1.542 0 CA-C-O 117.992 -1.004 . . . . 74.33 113.131 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.767 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 20.8 Cg_endo -57.68 -38.66 92.5 Favored 'Trans proline' 0 C--N 1.396 3.053 0 C-N-CA 122.218 1.945 . . . . 72.33 112.243 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.451 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.5 mm? -66.64 -36.34 82.34 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.609 -0.723 . . . . 72.25 111.296 178.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -73.53 -29.42 62.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.913 0.885 . . . . 75.21 111.666 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.538 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 24.7 mmt -64.9 -33.39 75.91 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.828 0.451 . . . . 75.31 111.336 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.38 -41.5 14.43 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.572 0.349 . . . . 73.33 111.773 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -58.86 -45.82 89.21 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.543 0.737 . . . . 75.42 111.95 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -87.05 -20.75 26.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.435 0.694 . . . . 73.2 111.167 -171.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -102.58 -59.87 1.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.086 -0.506 . . . . 72.13 110.385 -172.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.89 85.28 0.39 Allowed Glycine 0 C--N 1.343 0.951 0 CA-C-N 115.79 -0.641 . . . . 73.43 111.598 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.06 95.66 0.17 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 109.518 -0.549 . . . . 74.24 109.518 178.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -68.77 90.24 0.41 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.864 0.866 . . . . 72.33 110.586 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 21.3 m -71.85 -7.29 47.52 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.348 -1.296 . . . . 71.14 112.446 -175.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.3 t -113.06 90.19 15.47 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 108.432 -0.951 . . . . 73.12 108.432 169.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.428 ' HA ' HD21 ' A' ' 58' ' ' LEU . 96.0 Cg_endo -89.34 112.51 0.56 Allowed 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.423 2.082 . . . . 64.15 111.113 173.557 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.2 p -62.44 156.45 22.69 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.953 0.501 . . . . 71.34 110.197 176.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -54.21 -51.78 63.34 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.634 0.774 . . . . 74.35 110.85 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -55.85 -38.73 70.45 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.932 0.893 . . . . 71.03 112.351 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 62' ' ' MET . 62.0 tp -67.65 -51.89 44.56 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 124.059 0.944 . . . . 73.12 109.275 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.3 m -61.64 -36.69 81.51 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.281 1.032 . . . . 75.13 111.521 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.8 m -66.67 -47.78 71.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.334 0.654 . . . . 71.11 109.382 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 65' ' ' PHE . . . -56.43 -41.29 76.15 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.722 -0.672 . . . . 75.34 110.178 175.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 58' ' ' LEU . 25.1 mmt -67.25 -28.45 68.05 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.987 0.915 . . . . 72.23 111.934 177.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -70.29 -49.08 53.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.84 0.456 . . . . 74.43 110.767 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -68.19 -33.77 75.06 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 120.529 0.204 . . . . 74.41 110.562 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 1.8 t80 -61.1 -56.25 23.03 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.945 1.298 . . . . 75.11 109.674 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.435 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 48.8 tttm -55.77 -50.06 71.46 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.224 -1.353 . . . . 74.15 110.695 175.437 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.47 -49.86 69.08 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.104 0.961 . . . . 72.43 112.15 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.34 -28.85 64.37 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.412 0.685 . . . . 63.4 111.722 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.4 mt -75.64 -28.18 58.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.718 0.407 . . . . 74.32 111.696 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 51.4 mt-10 -69.92 -42.69 72.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 109.445 -0.576 . . . . 75.05 109.445 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -63.66 -45.38 90.42 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.979 -1.009 . . . . 73.23 110.354 176.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.6 98.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.278 0.631 . . . . 74.11 111.39 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -57.8 -44.8 86.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.763 1.225 . . . . 71.13 110.265 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -68.23 -32.98 77.03 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 114.764 -1.107 . . . . 64.33 113.209 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -68.0 -51.06 51.53 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 116.915 0.357 . . . . 72.22 110.866 -179.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.479 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.4 OUTLIER -66.44 -28.79 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 118.269 0.486 . . . . 74.42 112.284 175.541 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -60.74 -41.71 95.93 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.867 -0.79 . . . . 65.21 108.867 172.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -69.25 -39.61 78.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.842 1.257 . . . . 74.41 111.008 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.479 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 18.4 m-85 -81.46 5.45 17.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.996 0.918 . . . . 74.51 112.443 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.9 p -56.7 -32.56 65.59 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.214 0.53 . . . . 65.41 110.199 171.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -86.99 117.56 25.79 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.922 -1.036 . . . . 70.23 109.209 168.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.492 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.4 mpt_? -78.87 -26.17 43.94 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.229 1.012 . . . . 64.13 109.803 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -61.26 -38.65 87.45 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.92 0.888 . . . . 75.24 110.601 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.64 -44.26 96.59 Favored 'General case' 0 C--O 1.257 1.45 0 C-N-CA 124.265 1.026 . . . . 75.42 110.595 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.569 HG23 ' HG ' ' A' ' 24' ' ' CYS . 19.6 mt -60.93 -54.86 29.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 CA-C-N 115.091 -0.958 . . . . 64.11 109.611 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.8 t -54.66 -43.05 72.06 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.556 0.743 . . . . 63.51 111.235 -177.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 49.3 ttm-85 -56.67 -54.98 39.83 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.508 1.13 . . . . 74.12 111.362 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.468 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.18 -26.32 56.07 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.508 -0.314 . . . . 74.21 110.541 -176.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp -71.24 -43.72 66.73 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.077 0.951 . . . . 72.32 110.701 -170.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.6 t -65.08 -19.81 66.17 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.074 -0.966 . . . . 75.45 110.805 177.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.55 -26.97 14.24 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.312 1.045 . . . . 72.54 112.175 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 90.9 p -74.38 118.18 17.04 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.774 0.429 . . . . 73.13 110.255 -172.174 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -68.89 -30.61 69.14 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.31 0.644 . . . . 71.22 110.341 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.46 ' HB3' ' HD3' ' A' ' 99' ' ' LYS . 4.9 m-20 -65.12 -41.48 94.82 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.317 -1.31 . . . . 75.3 109.917 176.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.566 ' HD2' ' HD2' ' A' ' 145' ' ' ARG . 6.2 mtmp? 67.06 12.47 8.99 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.843 1.257 . . . . 74.05 111.066 -175.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.658 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 12.9 mt -125.42 119.87 56.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.984 -1.117 . . . . 65.34 107.984 -178.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . 0.468 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 7.1 mp -53.26 -39.22 63.69 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.699 1.599 . . . . 74.53 112.2 175.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.473 ' HZ ' HG21 ' A' ' 76' ' ' ILE . 81.6 m-85 -122.87 35.07 4.96 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.331 0.653 . . . . 74.25 111.16 -173.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.658 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 38.3 tttm -63.3 -52.42 62.01 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.066 0.848 . . . . 72.13 110.45 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -75.02 -37.63 61.72 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.653 -0.703 . . . . 71.12 110.737 -175.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.69 -39.08 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 122.598 0.359 . . . . 75.34 110.814 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.4 -25.33 50.72 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.082 0.553 . . . . 75.41 110.767 176.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.71 -43.93 97.9 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.63 -0.507 . . . . 74.12 109.63 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -58.68 7.41 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.375 -0.602 . . . . 75.32 109.375 171.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.4 mt -54.42 -32.55 57.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.823 0.849 . . . . 72.44 112.466 -177.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.9 t -78.36 -47.1 18.39 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.631 0.772 . . . . 71.23 111.237 -176.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.648 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 22.5 t70 -69.34 -41.36 76.75 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 121.427 0.632 . . . . 53.22 110.436 -177.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.18 -48.54 86.52 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 CA-C-N 114.792 -1.095 . . . . 74.45 109.706 171.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.578 ' HE3' HD22 ' A' ' 112' ' ' LEU . 10.6 t-105 -63.15 -25.62 68.43 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.333 0.653 . . . . 75.24 112.119 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.648 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.6 mtpt -63.66 -63.05 1.28 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.701 -0.851 . . . . 74.24 108.701 171.83 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.33 -47.23 72.75 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.91 0.862 . . . . 73.31 110.679 -177.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.578 HD22 ' HE3' ' A' ' 109' ' ' TRP . 47.5 tp -60.11 -56.25 23.89 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 112.902 -1.954 . . . . 75.41 110.529 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.419 ' HB2' HG12 ' A' ' 124' ' ' VAL . 91.3 p -61.25 -33.86 74.21 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.562 0.345 . . . . 75.45 111.843 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.3 mt -63.33 -54.86 30.32 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 123.814 0.696 . . . . 75.23 110.134 176.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 pp -69.38 -23.7 63.77 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 111.84 0.311 . . . . 75.32 111.84 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.439 HD12 ' SD ' ' A' ' 122' ' ' MET . 85.8 mt -70.78 -45.03 65.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.891 0.476 . . . . 72.42 111.28 174.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -79.29 -31.11 43.23 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 122.111 -0.368 . . . . 75.31 111.6 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 76.3 t -83.47 -48.64 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 C-N-CA 122.7 0.4 . . . . 64.11 110.965 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -90.85 -57.94 2.64 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.272 0.558 . . . . 75.32 111.22 -176.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -83.03 -0.76 50.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.577 -0.738 . . . . 73.42 111.644 -170.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 62.26 24.16 14.35 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.156 1.382 . . . . 73.32 113.44 171.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.767 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 49.1 ttm -78.06 131.66 69.15 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 123.936 0.894 . . . . 72.43 110.396 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.25 96.97 1.12 Allowed 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.127 1.885 . . . . 75.14 111.799 179.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.419 HG12 ' HB2' ' A' ' 113' ' ' SER . 28.0 t -126.73 143.77 39.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.404 0.682 . . . . 74.33 109.382 177.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 47.5 t -163.55 -63.67 0.01 OUTLIER Pre-proline 0 CA--C 1.57 1.718 0 N-CA-C 112.857 0.688 . . . . 72.34 112.857 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.81 -14.56 26.84 Favored 'Trans proline' 0 C--N 1.392 2.832 0 C-N-CA 122.259 1.973 . . . . 72.55 114.073 -164.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.6 tt -110.53 -16.36 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.222 1.009 . . . . 75.31 111.236 -171.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 19.6 m -64.93 -47.89 76.09 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.591 0.756 . . . . 74.21 110.613 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -58.43 -30.11 66.65 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.454 -1.248 . . . . 71.25 112.051 176.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 62.28 26.27 67.63 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.743 0.652 . . . . 74.02 113.702 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.93 -44.53 80.43 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 75.44 110.476 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 90.6 p -63.77 -50.85 67.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.401 -0.818 . . . . 74.21 109.842 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -52.19 -38.33 57.47 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.338 1.455 . . . . 75.32 113.364 -176.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.63 -55.28 16.01 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.155 0.582 . . . . 75.2 110.281 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -29.41 70.61 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.186 -0.915 . . . . 73.41 111.7 -177.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.687 ' HB3' ' HD2' ' A' ' 30' ' ' ARG . 34.9 mt-10 -57.04 -60.46 3.56 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.706 1.202 . . . . 73.42 110.787 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.525 ' HB3' HD12 ' A' ' 96' ' ' ILE . 32.5 m-20 -56.36 -39.8 73.48 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 116.293 -0.412 . . . . 74.22 111.431 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.23 -64.45 0.86 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 123.141 0.276 . . . . 74.4 111.043 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -62.36 -50.54 71.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.571 0.701 . . . . 53.54 110.674 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . 0.538 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 3.1 m-20 -75.48 -40.54 57.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.234 -1.348 . . . . 73.44 112.135 -167.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . 0.473 ' HB3' HH22 ' A' ' 30' ' ' ARG . . . -74.36 -22.39 59.24 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 118.923 0.783 . . . . 63.03 111.269 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 35.7 t70 -70.98 -34.5 71.46 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 109.76 -0.459 . . . . 72.52 109.76 169.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -68.62 -35.46 77.34 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.203 0.601 . . . . 73.35 111.199 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.38 -36.45 68.73 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.156 0.582 . . . . 73.35 110.467 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . 0.566 ' HD2' ' HD2' ' A' ' 95' ' ' LYS . 45.1 ttt180 -58.37 -45.56 88.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.657 -1.156 . . . . 71.53 109.958 171.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 48.5 mtt180 -66.99 -39.9 87.24 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 116.104 -0.498 . . . . 74.04 110.321 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . 0.428 ' O ' HD11 ' A' ' 151' ' ' LEU . . . -71.16 -23.01 61.98 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.287 0.635 . . . . 74.44 111.617 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . 0.425 ' HB3' HE21 ' A' ' 149' ' ' GLN . 0.1 OUTLIER -86.95 -60.5 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.415 0.626 . . . . 64.3 111.251 175.452 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . 0.425 HE21 ' HB3' ' A' ' 148' ' ' PHE . 33.1 mm-40 -82.69 -27.09 31.48 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.904 -1.044 . . . . 74.33 112.654 -165.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.1 ttm -100.04 -70.88 0.72 Allowed 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.788 -0.819 . . . . 72.25 108.788 173.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . 0.433 HD22 ' O ' ' A' ' 154' ' ' ASP . 16.6 tp 63.1 162.73 0.1 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.221 1.409 . . . . 73.3 111.818 -179.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -151.72 70.82 0.96 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.338 -0.986 . . . . 74.25 108.338 174.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -171.16 -59.88 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.796 1.238 . . . . 64.33 107.926 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . 0.433 ' O ' HD22 ' A' ' 151' ' ' LEU . 26.8 t70 -126.4 163.71 22.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.233 1.013 . . . . 72.41 109.34 -175.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -164.27 162.06 22.27 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.44 0.696 . . . . 73.53 110.031 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? . . . . . 0 CA--C 1.557 1.229 0 CA-C-O 118.646 -0.692 . . . . 74.2 111.331 177.872 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 120.926 0.393 . . . . 74.24 110.146 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -68.04 -52.21 37.98 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.333 1.053 . . . . 71.31 110.109 -170.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -71.02 -29.28 65.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.692 -1.14 . . . . 74.52 110.842 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.412 HD21 HD11 ' A' ' 42' ' ' LEU . 0.9 OUTLIER -73.59 -40.17 64.08 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.162 -0.681 . . . . 75.23 109.162 -179.196 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.442 ' O ' ' HD3' ' A' ' 5' ' ' LYS . 6.8 tmtt? -71.38 -30.98 66.77 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.305 -0.998 . . . . 75.23 108.305 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.491 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 57.5 t-80 -64.61 -40.61 95.8 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 119.304 -0.379 . . . . 65.43 110.14 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 93.6 mt -56.83 -46.14 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 C-N-CA 124.262 1.025 . . . . 74.54 110.526 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.493 HD12 ' HG2' ' A' ' 43' ' ' GLU . 34.1 mm -54.54 -54.15 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 115.16 -0.927 . . . . 73.43 110.547 174.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.2 m -57.52 -40.1 78.03 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 124.409 1.084 . . . . 73.42 111.252 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 93.4 mt -61.18 -57.9 10.53 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 123.923 0.764 . . . . 75.3 109.99 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.592 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.18 -36.04 73.17 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 124.65 1.219 . . . . 74.4 113.583 -176.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -62.8 -54.39 39.69 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.876 0.47 . . . . 70.32 110.904 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.62 -31.19 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.73 0.812 . . . . 74.23 111.269 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.495 HG21 HD11 ' A' ' 76' ' ' ILE . 36.5 mt -61.96 -60.12 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.612 1.165 . . . . 74.4 109.261 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -66.27 -27.83 68.24 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 123.249 0.343 . . . . 70.41 111.002 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -63.46 -48.41 77.82 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.712 . . . . 73.23 110.55 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -83.93 -16.2 45.1 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.001 0.521 . . . . 75.22 111.888 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 42.6 t -66.27 -21.58 66.29 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.056 0.543 . . . . 72.54 110.354 172.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.78 -21.59 66.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.6 0.76 . . . . 65.52 111.855 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -68.33 -14.15 62.79 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.205 0.602 . . . . 74.54 112.47 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' MET . . . . . 0.467 ' HE3' HG22 ' A' ' 76' ' ' ILE . 9.4 mmt -77.07 85.34 3.57 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.088 0.47 . . . . 65.52 110.352 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -40.79 76.55 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.673 -0.862 . . . . 72.42 108.673 167.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -106.81 164.82 11.79 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.484 -1.235 . . . . 73.31 109.216 170.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.633 ' SG ' HG22 ' A' ' 85' ' ' ILE . 29.3 m 58.93 53.26 5.78 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 124.342 1.026 . . . . 71.25 110.023 -167.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.504 ' HB3' ' HZ2' ' A' ' 25' ' ' LYS . 7.4 mtpm? -73.84 -42.16 61.24 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.008 -1.451 . . . . 74.33 111.765 -170.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.488 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 22.5 tptp -74.33 -45.02 49.95 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.208 -0.905 . . . . 74.24 109.867 -170.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -76.23 -22.22 55.46 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 116.026 -0.534 . . . . 74.21 111.24 176.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.48 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 14.0 t -61.57 -50.92 70.7 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.756 -0.461 . . . . 71.44 109.756 169.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -62.07 -38.7 89.82 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.181 0.925 . . . . 75.4 111.288 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HB3' HH21 ' A' ' 34' ' ' ARG . 4.1 mmp_? -51.06 -61.72 2.06 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.383 0.427 . . . . 71.44 110.01 172.099 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.62 -46.44 80.93 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.522 1.139 . . . . 71.31 110.887 -175.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.31 -49.89 58.94 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.967 0.792 . . . . 52.2 113.179 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -59.36 -38.13 79.63 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.536 0.735 . . . . 75.31 111.261 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.564 HH21 ' HB3' ' A' ' 30' ' ' ARG . 14.5 mtt180 -60.44 -59.42 5.44 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 123.721 0.638 . . . . 71.44 110.477 175.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.494 HG23 HG23 ' A' ' 14' ' ' ILE . 53.6 t -57.68 -41.07 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 124.516 1.135 . . . . 63.42 111.467 -174.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.17 -43.23 98.86 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.704 0.628 . . . . 71.33 110.053 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.88 -22.55 72.16 Favored Glycine 0 CA--C 1.537 1.43 0 O-C-N 123.448 0.468 . . . . 73.43 113.442 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 39.4 mt -84.35 -44.78 13.44 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 122.833 0.453 . . . . 63.21 110.983 178.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.592 HG21 ' HA3' ' A' ' 11' ' ' GLY . 13.3 pt -85.17 -25.06 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-O 118.964 -0.541 . . . . 65.24 111.989 -172.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -54.41 -56.01 31.24 Favored Pre-proline 0 CA--C 1.571 1.787 0 C-N-CA 123.598 0.759 . . . . 72.23 112.336 -176.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.458 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 87.9 Cg_endo -72.28 -33.82 8.65 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.025 1.817 . . . . 71.22 111.944 -175.208 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD11 HD21 ' A' ' 4' ' ' LEU . 4.4 mm? -65.37 -39.5 92.38 Favored 'General case' 0 C--N 1.352 0.685 0 O-C-N 123.934 0.771 . . . . 75.01 109.497 176.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.493 ' HG2' HD12 ' A' ' 8' ' ' ILE . 3.7 mm-40 -64.4 -39.92 94.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.107 0.963 . . . . 74.21 111.443 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 31.9 mmt -60.36 -53.52 56.59 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 123.658 0.599 . . . . 71.03 110.549 177.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.6 mt -71.5 -26.6 62.74 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.565 0.746 . . . . 75.15 112.187 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -46.42 26.36 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.964 0.906 . . . . 74.35 109.464 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.02 -34.58 78.78 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.256 0.623 . . . . 72.22 110.771 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -65.55 -45.84 81.82 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.723 -0.671 . . . . 74.1 109.647 170.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.58 46.79 23.71 Favored Glycine 0 C--N 1.343 0.943 0 CA-C-N 115.731 -0.668 . . . . 53.34 111.792 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -78.42 132.92 37.52 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.149 0.579 . . . . 73.34 110.205 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 92.1 mtt180 -65.18 96.36 0.21 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.627 0.771 . . . . 74.24 110.786 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.433 ' HB3' ' NE2' ' A' ' 120' ' ' GLN . 49.9 m -92.01 163.18 14.08 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.973 -1.012 . . . . 74.03 110.174 177.414 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.16 109.39 58.39 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.357 0.663 . . . . 71.41 109.375 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_exo -73.11 174.74 11.53 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 122.71 2.273 . . . . 64.04 112.487 172.301 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.584 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 45.2 t -153.53 165.13 36.84 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.706 1.203 . . . . 64.4 108.091 178.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.45 -44.83 81.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.749 0.42 . . . . 73.54 110.276 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -70.95 -29.16 65.09 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.835 0.854 . . . . 64.22 111.166 176.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 55' ' ' SER . 1.7 tm? -62.17 -48.66 79.07 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 107.825 -1.176 . . . . 72.13 107.825 176.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -64.88 -41.31 95.73 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.94 -1.027 . . . . 71.22 110.587 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.8 m -60.77 -44.66 96.48 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.696 0.623 . . . . 73.41 110.668 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.95 97.53 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.769 0.827 . . . . 52.44 110.102 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.97 -26.11 64.88 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.322 0.649 . . . . 72.42 111.564 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -75.65 -39.49 57.61 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.198 0.599 . . . . 75.41 110.393 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -72.13 -33.29 67.67 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.53 0.732 . . . . 64.21 110.335 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.71 -48.01 64.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.293 1.037 . . . . 74.11 108.785 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -55.47 -53.29 58.12 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 124.592 1.157 . . . . 70.13 110.591 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.67 94.09 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.559 0.743 . . . . 75.02 111.531 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.65 -36.12 81.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.506 0.722 . . . . 64.41 111.38 -179.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 mt -71.36 -33.59 69.71 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.875 0.47 . . . . 73.54 111.057 177.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -67.05 -34.89 78.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.681 0.392 . . . . 72.43 110.174 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 46.8 mt-10 -64.55 -44.12 91.78 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.626 -0.715 . . . . 74.11 110.741 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.483 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.91 -46.73 89.48 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 123.545 0.528 . . . . 74.1 110.646 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -56.87 -44.03 81.84 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.152 1.381 . . . . 74.33 110.22 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.01 -40.43 97.11 Favored Glycine 0 C--N 1.35 1.341 0 O-C-N 124.058 0.849 . . . . 73.51 113.322 178.598 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 8.4 mm-40 -59.9 -60.29 4.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.946 0.498 . . . . 74.25 110.509 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.542 HG21 ' HZ ' ' A' ' 98' ' ' PHE . 1.4 pt -66.97 -20.31 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 112.586 0.588 . . . . 74.1 112.586 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -63.4 -48.74 76.58 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.819 -0.808 . . . . 71.44 108.819 171.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.507 ' HG2' ' ND2' ' A' ' 84' ' ' ASN . 35.0 ttmt -76.18 -25.38 55.16 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.693 -0.685 . . . . 75.11 111.224 -177.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.47 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-30 -75.35 -4.38 38.98 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.513 0.725 . . . . 51.15 112.549 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.4 p -57.43 -25.54 59.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.983 0.513 . . . . 74.31 111.42 173.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -90.98 111.93 23.59 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 107.986 -1.116 . . . . 71.12 107.986 169.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -76.56 -29.74 56.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.657 0.783 . . . . 74.13 110.911 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.7 p -69.9 -31.65 69.55 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.035 0.534 . . . . 71.34 110.642 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.507 ' ND2' ' HG2' ' A' ' 78' ' ' LYS . 41.1 t30 -62.89 -44.44 96.09 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 123.601 0.76 . . . . 73.04 110.172 174.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.633 HG22 ' SG ' ' A' ' 24' ' ' CYS . 34.5 mt -57.17 -55.06 22.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.155 0 O-C-N 124.337 1.023 . . . . 74.33 108.918 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 36.5 t -53.73 -39.94 65.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 124.2 0.938 . . . . 74.22 111.866 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -63.41 -43.77 96.54 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 123.918 0.761 . . . . 75.22 111.585 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -28.35 45.84 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 110.17 -0.307 . . . . 73.22 110.17 177.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.04 -26.5 43.14 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.454 1.102 . . . . 73.21 111.061 -167.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.1 t -76.92 -28.16 55.18 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.882 -0.599 . . . . 74.41 110.412 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.01 -44.69 29.95 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.554 0.742 . . . . 64.01 110.651 178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.0 p -89.55 116.1 27.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.659 0.784 . . . . 73.11 109.007 177.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -96.1 -49.88 5.07 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.122 0.419 . . . . 74.42 111.563 -175.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -97.46 -43.26 7.34 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.633 -0.506 . . . . 74.13 109.633 -176.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.403 ' HE2' ' HB3' ' A' ' 99' ' ' LYS . 13.7 tmtt? -48.22 107.6 0.13 Allowed 'General case' 0 C--N 1.36 1.04 0 O-C-N 125.632 1.832 . . . . 73.04 110.325 -175.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 137' ' ' ASP . 2.5 mp -58.0 147.78 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 124.112 0.965 . . . . 72.41 109.248 -177.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.4 tp -47.53 -42.27 22.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.284 1.033 . . . . 70.01 111.331 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PHE . . . . . 0.542 ' HZ ' HG21 ' A' ' 76' ' ' ILE . 32.7 m-85 -120.73 32.27 6.06 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 114.697 -1.138 . . . . 74.41 111.181 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.403 ' HB3' ' HE2' ' A' ' 95' ' ' LYS . 60.1 tttp -48.54 -63.22 1.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.905 0.882 . . . . 74.54 112.792 -175.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.87 -48.91 67.34 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.896 0.879 . . . . 52.24 111.12 -174.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.62 -40.01 85.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 114.713 -1.13 . . . . 62.41 110.981 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -76.95 -28.85 55.36 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.1 0.56 . . . . 72.13 110.74 -176.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -61.88 -40.83 96.76 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 109.045 -0.724 . . . . 75.11 109.045 172.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.64 -48.64 71.5 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 123.762 0.663 . . . . 75.25 111.191 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.4 mp -55.3 -47.05 76.16 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.277 0.631 . . . . 73.44 110.534 177.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.503 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 33.6 t -65.26 -49.89 67.86 Favored 'General case' 0 C--O 1.212 -0.917 0 O-C-N 124.347 1.03 . . . . 75.22 110.599 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -56.34 -56.38 21.79 Favored 'General case' 0 C--O 1.261 1.669 0 O-C-N 124.224 0.953 . . . . 74.24 110.734 -176.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.523 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 47.8 t -62.33 -42.04 93.95 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.185 0 CA-C-N 113.926 -1.488 . . . . 72.31 110.136 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TRP . . . . . 0.701 ' HH2' HG12 ' A' ' 124' ' ' VAL . 20.1 t-105 -62.94 -43.46 98.74 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.734 0.646 . . . . 74.2 112.289 -179.444 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 106' ' ' SER . 47.7 mtmt -59.52 -56.35 23.09 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.783 -0.451 . . . . 75.43 109.783 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.57 -21.76 61.83 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.881 -0.6 . . . . 73.45 111.862 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.523 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 3.3 tp -66.35 -60.0 3.17 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 107.158 -1.423 . . . . 74.43 107.158 176.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.8 t -52.72 -41.74 64.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 114.428 -1.26 . . . . 75.04 111.018 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 89.8 mt -58.6 -60.39 3.89 Favored 'General case' 0 C--N 1.361 1.076 0 O-C-N 124.149 0.906 . . . . 72.33 111.346 177.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.31 -27.76 69.25 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 120.698 0.285 . . . . 75.43 111.741 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.559 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 83.1 mt -67.13 -56.56 9.44 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 123.205 0.602 . . . . 74.55 110.389 177.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.71 -31.34 66.63 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.357 0.502 . . . . 73.25 112.357 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 88.1 t -77.13 -57.36 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.438 0.461 . . . . 73.4 110.261 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -97.04 -57.32 2.3 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.099 0.56 . . . . 74.32 111.16 -168.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.433 ' NE2' ' HB3' ' A' ' 52' ' ' SER . 0.0 OUTLIER -74.67 -1.49 22.0 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.267 0.627 . . . . 62.12 111.37 -175.526 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 65.62 12.42 8.22 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.632 1.573 . . . . 72.45 112.182 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' MET . . . . . 0.559 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 66.8 mtp -87.01 110.96 37.18 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.176 0.99 . . . . 72.34 110.691 -173.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -82.43 65.79 8.22 Favored 'Trans proline' 0 C--N 1.372 1.78 0 C-N-CA 123.19 2.593 . . . . 64.42 111.4 -177.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' VAL . . . . . 0.701 HG12 ' HH2' ' A' ' 109' ' ' TRP . 37.9 t -95.77 89.33 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.251 -0.886 . . . . 75.44 110.595 -169.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 66.0 m -148.03 73.07 11.24 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.878 0.871 . . . . 72.1 109.281 175.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.458 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 10.0 Cg_endo -98.11 14.58 0.69 Allowed 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.326 2.684 . . . . 72.42 113.897 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.585 HG22 ' H ' ' A' ' 128' ' ' SER . 8.6 tt -141.4 -84.02 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-O 119.076 -0.488 . . . . 75.22 109.816 -174.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' SER . . . . . 0.585 ' H ' HG22 ' A' ' 127' ' ' ILE . 68.9 m -159.35 -81.04 0.05 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.775 -1.195 . . . . 74.11 107.775 173.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . 0.434 ' HG2' ' HG2' ' A' ' 110' ' ' LYS . 26.4 tt0 179.59 -34.05 0.01 OUTLIER 'General case' 0 C--N 1.363 1.162 0 C-N-CA 124.239 1.016 . . . . 75.25 110.135 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.9 -9.21 8.57 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.57 -0.572 . . . . 73.21 114.089 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.41 90.99 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.408 0.683 . . . . 74.32 111.113 176.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 14.6 m -56.85 -36.29 69.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.593 1.157 . . . . 73.43 111.454 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' TRP . . . . . 0.415 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 47.4 m0 -63.12 -27.89 69.69 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.138 0.975 . . . . 75.44 112.187 -174.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.9 74.51 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 122.782 0.433 . . . . 72.35 111.544 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -89.73 -39.69 12.99 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.644 0.778 . . . . 72.12 111.135 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . 0.408 ' HB2' ' HA ' ' A' ' 133' ' ' TRP . 20.5 mm-40 -65.92 -64.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.076 0.55 . . . . 71.41 110.878 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.42 ' HB3' HG23 ' A' ' 96' ' ' ILE . 3.7 m-20 -48.14 -36.56 13.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.554 1.142 . . . . 71.43 112.324 178.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -66.83 -58.7 4.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.73 0.812 . . . . 75.1 111.269 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.89 -39.05 87.8 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.445 0.641 . . . . 73.13 110.754 -177.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -65.81 -39.29 90.75 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 114.479 -1.237 . . . . 75.2 110.229 176.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.03 -48.9 79.81 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.648 0.379 . . . . 74.25 111.03 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.04 -54.05 51.33 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 124.248 0.967 . . . . 72.34 111.298 177.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -76.6 -21.96 54.86 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.33 0.863 . . . . 74.44 113.33 -172.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 32.4 t0 -86.71 -34.55 19.66 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.917 -0.401 . . . . 65.02 109.917 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -65.95 -38.19 87.95 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.043 -0.526 . . . . 72.43 109.985 168.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -64.3 -41.83 96.66 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.37 -0.832 . . . . 73.45 109.576 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.28 -27.57 60.8 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.502 0.721 . . . . 74.43 111.931 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.18 -58.29 3.36 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.461 -0.57 . . . . 64.01 109.461 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -67.59 -44.3 78.45 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.655 -1.157 . . . . 74.14 111.255 -172.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 46.6 ttm -83.7 -79.3 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.33 -0.618 . . . . 74.22 109.33 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 61.0 tp 56.21 -74.81 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.457 1.103 . . . . 75.4 111.202 -172.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? 88.58 -25.84 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.554 1.942 . . . . 73.51 110.138 165.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -48.27 -60.28 2.78 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.393 1.477 . . . . 73.31 111.681 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -172.23 94.21 0.14 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.85 0.86 . . . . 74.02 108.836 -174.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -96.95 68.4 2.31 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.029 0.932 . . . . 75.23 110.427 -172.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 C-N-CA 123.252 0.621 . . . . 75.4 109.737 179.369 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 112.855 0.687 . . . . 75.32 112.855 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.69 -37.51 87.63 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.303 0.641 . . . . 71.44 110.441 -174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.646 ' HG ' ' SD ' ' A' ' 62' ' ' MET . 7.4 tt -62.46 -40.73 97.59 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.837 -1.074 . . . . 74.23 109.836 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.64 -32.0 71.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.692 0.797 . . . . 74.44 110.519 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -63.98 -40.01 95.42 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 119.336 -0.364 . . . . 75.5 110.659 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.498 HD13 ' HB3' ' A' ' 65' ' ' PHE . 29.4 mt -59.51 -46.05 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 CA-C-O 120.979 0.419 . . . . 74.12 110.493 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 4' ' ' LEU . 46.1 mm -61.98 -45.7 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.101 -0.954 . . . . 75.31 111.139 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.7 m -62.75 -53.04 60.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.791 0.836 . . . . 65.44 110.248 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.6 mt -50.13 -47.24 54.22 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 124.487 1.117 . . . . 73.53 110.221 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.444 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.42 -52.81 50.56 Favored Glycine 0 C--N 1.342 0.877 0 O-C-N 124.243 0.964 . . . . 75.14 113.809 -175.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.0 -40.28 94.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.585 0.354 . . . . 71.33 111.286 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 65.2 t -64.91 -38.52 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 115.798 -0.637 . . . . 52.21 110.825 176.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.557 HD11 ' O ' ' A' ' 69' ' ' LEU . 20.1 mt -63.65 -51.46 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.45 1.1 . . . . 74.02 110.079 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.512 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 69.8 t60 -54.91 -46.76 74.92 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.46 1.1 . . . . 73.31 109.632 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.1 tptm -62.63 -53.71 50.51 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 124.505 1.128 . . . . 73.43 111.91 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.6 ptp180 -74.48 -22.67 58.97 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.792 0.437 . . . . 64.34 111.772 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.511 ' SG ' HD23 ' A' ' 31' ' ' LEU . 52.4 t -67.0 -26.0 66.58 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.609 0.364 . . . . 50.33 111.292 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HG3' ' O ' ' A' ' 15' ' ' HIS . 44.4 mt-10 -74.32 5.72 4.3 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 112.966 0.728 . . . . 71.14 112.966 -175.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.479 ' HG3' ' NH1' ' A' ' 82' ' ' ARG . 14.8 pt-20 -86.15 -13.85 45.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.687 0.395 . . . . 74.34 111.439 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.527 ' HA ' ' HD2' ' A' ' 82' ' ' ARG . 14.2 mmt -76.24 95.07 3.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.846 0.458 . . . . 55.51 110.452 -176.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -73.07 -32.64 65.14 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.321 0.582 . . . . 74.24 109.937 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -94.61 153.8 17.67 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.335 -0.987 . . . . 71.14 108.335 166.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' HD11 ' A' ' 97' ' ' LEU . 95.3 m 60.51 55.33 3.46 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 124.131 0.894 . . . . 70.11 110.342 -170.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.81 -48.2 59.96 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.183 -0.917 . . . . 63.14 111.022 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.3 mtpm? -72.7 -32.99 66.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.881 0.472 . . . . 74.44 110.421 -173.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG2' HH12 ' A' ' 30' ' ' ARG . 48.0 mt-30 -71.64 -31.09 66.47 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.368 0.267 . . . . 74.44 111.174 172.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.6 t -67.41 -39.44 85.53 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.257 0.623 . . . . 63.54 110.532 173.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -74.4 -32.12 62.59 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 114.849 -1.069 . . . . 72.12 110.749 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.567 HH12 ' HG2' ' A' ' 27' ' ' GLN . 40.0 ttp-105 -77.61 -39.91 43.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.32 0.648 . . . . 74.41 110.205 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.511 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.6 tp -61.25 -47.14 87.38 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.713 -0.847 . . . . 73.11 108.713 172.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.37 -41.09 98.34 Favored Glycine 0 C--N 1.351 1.415 0 O-C-N 123.928 0.767 . . . . 54.53 113.004 176.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -59.98 -51.85 67.92 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.063 0.945 . . . . 74.44 110.677 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.584 ' NH2' ' HB3' ' A' ' 133' ' ' TRP . 34.9 mtt180 -59.78 -62.39 1.91 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.201 -1.363 . . . . 72.51 110.632 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.4 t -51.13 -46.31 31.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 124.453 1.096 . . . . 44.23 111.951 -173.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.559 HD23 HD11 ' A' ' 39' ' ' ILE . 94.7 mt -67.46 -44.25 79.1 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.415 0.447 . . . . 64.2 110.745 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.38 -19.44 62.13 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.266 0.354 . . . . 75.33 113.741 175.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 81.0 mt -86.69 -52.58 5.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.825 0.85 . . . . 71.35 111.995 177.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.559 HD11 HD23 ' A' ' 36' ' ' LEU . 12.7 pt -73.99 -46.69 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 118.758 -0.639 . . . . 72.23 111.769 -169.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.502 ' HE2' ' HB3' ' A' ' 36' ' ' LEU . 68.3 mttm -53.57 -50.22 84.38 Favored Pre-proline 0 N--CA 1.489 1.506 0 CA-C-O 118.416 -0.802 . . . . 63.13 113.094 -173.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.419 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.4 Cg_exo -55.87 -54.02 4.7 Favored 'Trans proline' 0 C--N 1.395 3.005 0 C-N-CA 121.963 1.775 . . . . 43.41 112.045 176.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HA ' HD12 ' A' ' 45' ' ' LEU . 4.3 mm? -64.39 -23.36 67.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.488 0.715 . . . . 62.23 111.647 -176.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 45.7 mt-10 -71.65 -44.18 64.77 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.739 0.816 . . . . 71.13 110.572 172.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 32.7 mmt -69.55 -26.89 64.71 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.529 0.518 . . . . 73.2 110.983 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 42' ' ' LEU . 39.2 mt -78.61 -37.14 43.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 64.03 109.987 176.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -68.84 -32.63 72.45 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 115.648 -0.705 . . . . 73.52 110.123 174.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 124.404 1.082 . . . . 73.35 110.907 -179.208 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 110.609 -0.145 . . . . 74.11 110.609 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.06 -42.73 77.09 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.796 0.438 . . . . 63.33 110.075 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.53 -45.68 88.38 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.09 -0.959 . . . . 64.33 111.75 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.445 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 97.6 mt -74.14 -37.08 64.15 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.816 0.846 . . . . 72.23 111.115 -172.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 67.0 m -62.6 -55.46 26.9 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.95 0.781 . . . . 71.41 109.203 175.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 26.4 m -62.89 -36.03 81.97 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.755 -0.657 . . . . 74.41 111.246 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.53 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.08 -48.93 74.27 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.388 0.675 . . . . 53.12 111.016 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.646 ' SD ' ' HG ' ' A' ' 4' ' ' LEU . 32.8 mmt -68.54 -30.08 68.79 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.548 -0.751 . . . . 72.34 111.992 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -76.37 -36.72 57.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.537 0.335 . . . . 70.43 111.165 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -67.41 -41.92 84.1 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.604 0.762 . . . . 71.45 109.512 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.513 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.03 -49.41 65.32 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.364 -0.834 . . . . 65.41 109.511 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.3 ttpp -53.59 -51.69 62.19 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.619 0.574 . . . . 73.1 110.267 178.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.98 89.51 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.263 0.977 . . . . 74.13 112.093 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.559 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.97 -44.5 92.56 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.755 0.822 . . . . 62.32 111.102 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.557 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -69.77 -29.45 66.79 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.247 -0.888 . . . . 75.42 110.708 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.7 mt-10 -65.76 -38.48 89.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.584 -0.697 . . . . 61.14 109.856 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.441 ' HB2' HG13 ' A' ' 101' ' ' VAL . 44.0 mt-10 -61.84 -52.2 65.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.45 -0.795 . . . . 73.42 110.144 174.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.7 79.93 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 123.876 0.735 . . . . 74.11 111.367 -178.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -59.64 -48.3 82.2 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.698 1.199 . . . . 61.31 110.645 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.23 91.71 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.195 -0.911 . . . . 35.31 113.18 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -67.77 -54.01 22.65 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 119.073 -0.489 . . . . 73.24 110.95 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.462 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -63.31 -33.71 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 112.02 0.378 . . . . 72.15 112.02 177.679 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.16 -33.22 75.5 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 120.973 0.416 . . . . 71.53 110.262 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -80.73 -27.78 36.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.5 0.72 . . . . 41.42 110.855 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.402 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.3 m-85 -87.1 9.4 19.96 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.004 0.922 . . . . 73.45 111.32 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -57.16 -16.79 8.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.073 0.949 . . . . 72.32 112.306 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -110.3 115.14 29.15 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 108.027 -1.101 . . . . 72.44 108.027 167.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.527 ' HD2' ' HA ' ' A' ' 21' ' ' MET . 1.0 OUTLIER -72.82 -24.65 60.93 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.423 0.689 . . . . 61.02 111.373 178.652 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 p -64.95 -37.47 87.75 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.311 0.644 . . . . 63.24 110.326 170.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.79 -38.28 86.21 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.856 0.862 . . . . 65.32 110.601 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.486 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.2 mt -57.7 -49.16 81.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 108.862 -0.792 . . . . 74.12 108.862 175.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.01 -35.08 79.02 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.425 0.453 . . . . 74.15 111.606 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -60.8 -45.11 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.699 0.624 . . . . 74.42 111.054 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.411 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -80.54 -27.51 37.56 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 110.384 -0.228 . . . . 62.22 110.384 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 14.6 tp -67.61 -44.25 78.5 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.518 1.127 . . . . 52.15 111.164 -171.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -65.63 -13.58 59.41 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.868 -1.06 . . . . 74.31 111.65 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.26 -21.75 12.4 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.082 0.953 . . . . 74.31 111.402 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 123.948 0.899 . . . . 53.11 110.147 -175.623 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.541 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 7.0 mt . . . . . 0 C--O 1.242 0.696 0 N-CA-C 108.259 -1.015 . . . . 71.11 108.259 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.557 HD11 ' SG ' ' A' ' 24' ' ' CYS . 20.2 mt -65.87 -54.1 31.11 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 122.142 0.972 . . . . 73.21 109.621 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.478 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 21.9 m-85 -94.44 36.72 1.14 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.628 -1.624 . . . . 74.24 109.947 -174.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.541 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 1.6 tmmt? -52.53 -62.46 1.63 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.152 0.433 . . . . 74.35 110.844 -176.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -61.85 -60.84 3.05 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.262 0.625 . . . . 74.43 110.802 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.9 t -50.34 -57.85 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.898 1.279 . . . . 64.42 112.807 -174.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.458 ' HA ' HD13 ' A' ' 105' ' ' LEU . 65.3 t30 -73.83 -22.25 59.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.985 -1.007 . . . . 64.44 110.349 -174.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.1 -43.65 95.39 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.203 -0.427 . . . . 73.25 110.126 166.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -56.75 -46.91 81.11 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 119.386 -0.34 . . . . 71.21 110.665 172.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.559 HD12 ' HB1' ' A' ' 68' ' ' ALA . 9.9 mp -53.21 -41.66 65.55 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 117.784 0.265 . . . . 52.2 111.142 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.439 ' HA ' ' HE3' ' A' ' 133' ' ' TRP . 38.9 t -67.53 -43.94 79.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.884 0.874 . . . . 43.45 111.577 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 68.7 m-20 -69.79 -55.16 10.59 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.411 -0.813 . . . . 72.35 110.243 -177.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.407 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.7 t -63.28 -32.75 57.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 119.532 -0.271 . . . . 54.53 111.225 -176.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -67.46 -48.18 67.95 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.02 -0.514 . . . . 74.44 111.738 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 41.4 pttt -60.72 -42.09 96.58 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 109.327 -0.62 . . . . 74.44 109.327 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.39 -35.56 75.91 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.391 1.076 . . . . 71.53 110.607 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.53 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.3 OUTLIER -61.14 -59.81 4.74 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 107.948 -1.131 . . . . 65.21 107.948 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.9 t -53.97 -35.49 61.87 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.905 -1.498 . . . . 62.41 110.973 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.2 mt -63.22 -62.95 1.35 Allowed 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.154 0.582 . . . . 62.41 111.533 172.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.48 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 3.8 pp -63.19 -28.61 70.16 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.134 0.42 . . . . 73.13 112.134 -173.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 91.7 mt -65.28 -57.9 7.28 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.292 -0.867 . . . . 72.34 109.878 173.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -68.17 -23.72 64.89 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 112.18 0.437 . . . . 72.34 112.18 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 85.4 t -83.94 -63.96 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.376 0.271 . . . . 71.21 111.003 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -93.87 -44.48 8.08 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 122.253 -0.279 . . . . 52.35 111.537 -170.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -71.21 -17.63 62.51 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 116.674 -0.239 . . . . 73.15 110.481 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 65.82 9.73 6.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.741 1.617 . . . . 74.21 111.363 -177.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.416 ' HA ' ' HD3' ' A' ' 123' ' ' PRO . 33.1 ttp -94.61 111.12 52.81 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.476 1.11 . . . . 75.35 109.432 -170.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 41.2 Cg_endo . . . . . 0 C--N 1.366 1.465 0 C-N-CA 124.004 3.136 . . . . 72.24 112.915 -165.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.584 ' HB3' ' NH2' ' A' ' 34' ' ' ARG . 12.3 m0 . . . . . 0 CA--C 1.548 0.881 0 N-CA-C 113.983 1.105 . . . . 75.53 113.983 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.35 93.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.289 0.236 . . . . 65.13 110.792 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -72.58 -32.34 65.93 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.393 0.677 . . . . 64.15 111.319 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HG2' ' HD2' ' A' ' 30' ' ' ARG . 29.4 tt0 -61.99 -58.67 6.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.694 0.798 . . . . 75.32 109.973 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -37.83 83.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.061 0.544 . . . . 75.1 111.835 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 142' ' ' ASP . 33.3 tt0 -56.01 -63.76 1.08 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.79 0.681 . . . . 73.4 110.948 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -71.46 -46.19 60.6 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.524 0.515 . . . . 73.44 110.862 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.94 -43.01 72.48 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.923 -0.58 . . . . 61.44 111.129 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 96' ' ' ILE . . . -78.05 -25.36 47.71 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 123.212 0.32 . . . . 71.2 111.096 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 138' ' ' GLN . 13.6 t70 -58.21 -53.72 55.1 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.318 -0.623 . . . . 70.22 109.318 170.078 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -58.65 -44.61 90.16 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 114.341 -1.3 . . . . 72.41 111.693 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 34.0 t70 -80.88 -32.25 34.97 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.952 0.782 . . . . 72.43 112.87 -168.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' A' ' 89' ' ' LEU . 3.6 tmt_? -70.2 -41.33 73.82 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.288 -1.005 . . . . 74.44 108.288 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 ttm180 -62.42 -37.44 85.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 114.726 -1.124 . . . . 73.23 109.954 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.87 -17.82 59.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.438 0.695 . . . . 73.34 111.396 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.488 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 1.6 t80 -69.98 -59.81 2.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.238 -1.023 . . . . 63.35 108.238 171.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -70.92 -38.65 72.95 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 113.874 -1.512 . . . . 52.33 111.595 -170.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 87.4 mmm -103.55 31.7 4.25 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.196 0.999 . . . . 71.23 110.131 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 C--N 1.36 1.035 0 CA-C-O 121.583 0.706 . . . . 65.21 109.574 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 119.772 -0.156 . . . . 64.44 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -59.65 -35.03 73.6 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.784 0.677 . . . . 73.44 111.562 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 30.5 tp -66.71 -44.56 81.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.888 0.475 . . . . 65.31 110.549 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -70.21 -25.35 63.36 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.791 0.436 . . . . 74.23 110.633 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -77.64 -29.96 51.98 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-O 118.993 -0.527 . . . . 72.13 110.768 173.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.46 -44.91 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 109.2 -0.667 . . . . 74.43 109.2 170.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 mm -60.42 -51.52 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-N 114.5 -1.227 . . . . 64.54 110.842 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.8 m -65.09 -56.77 11.09 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.329 0.652 . . . . 65.33 111.075 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.2 mt -51.7 -51.54 55.22 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.965 0.906 . . . . 72.3 111.199 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.26 -35.24 90.06 Favored Glycine 0 C--N 1.346 1.126 0 O-C-N 124.272 0.983 . . . . 74.12 114.05 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -69.16 -42.8 75.44 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.22 0.533 . . . . 65.13 109.729 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 62.8 t -62.06 -37.72 79.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-N 114.923 -1.035 . . . . 74.13 110.139 174.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.457 HG12 HD11 ' A' ' 76' ' ' ILE . 32.8 mt -58.04 -52.21 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.758 0.823 . . . . 73.14 110.131 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -60.16 -36.29 77.23 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.004 0.815 . . . . 73.32 110.982 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -66.29 -66.98 0.48 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 119.541 -0.266 . . . . 71.34 111.454 175.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -63.78 -20.17 65.56 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.355 0.872 . . . . 73.25 113.355 -172.342 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.5 t -65.33 -20.53 66.44 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.067 0.547 . . . . 72.21 112.077 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.28 -18.07 24.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.781 0.832 . . . . 65.23 113.07 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -65.85 -21.51 66.47 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.337 0.866 . . . . 62.31 113.337 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.525 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 7.6 mmt -75.57 87.7 2.68 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 121.16 0.505 . . . . 54.14 110.493 -173.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -35.59 63.79 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.787 -1.097 . . . . 70.41 108.447 170.146 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -92.64 152.89 19.31 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 108.129 -1.063 . . . . 71.2 108.129 169.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.5 p 50.54 60.11 4.09 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.243 1.017 . . . . 45.13 110.413 -171.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 47.4 mtmt -66.58 -45.32 79.62 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 114.491 -1.231 . . . . 61.21 111.371 -174.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -71.42 -36.8 71.43 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 108.194 -1.039 . . . . 72.0 108.194 -170.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.479 HE22 ' HB2' ' A' ' 141' ' ' ALA . 0.0 OUTLIER -56.45 -43.86 79.94 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.066 1.346 . . . . 73.01 112.231 169.092 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 32.8 t -60.94 -39.79 90.83 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.683 0.793 . . . . 72.34 110.889 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.9 mpt_? -81.23 -22.44 38.76 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.628 0.771 . . . . 74.54 111.1 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.45 -60.45 2.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.632 0.773 . . . . 73.3 109.166 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 29.0 tp -58.23 -40.52 81.9 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.425 1.09 . . . . 73.43 110.196 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.04 -51.04 59.73 Favored Glycine 0 C--N 1.354 1.54 0 O-C-N 123.965 0.791 . . . . 71.15 112.458 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -71.59 -32.99 68.65 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.082 0.553 . . . . 74.4 111.387 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.796 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.9 mtt180 -62.37 -63.58 1.19 Allowed 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.419 0.449 . . . . 61.42 109.812 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 14' ' ' ILE . 99.8 t -65.09 -41.14 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.549 -0.75 . . . . 72.44 111.219 -173.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.8 -40.94 98.9 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.344 0.592 . . . . 73.31 109.893 175.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.1 -22.09 75.84 Favored Glycine 0 C--O 1.216 -1.006 0 CA-C-N 114.702 -1.135 . . . . 51.21 113.083 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 90.5 mt -84.42 -39.7 18.68 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 117.838 0.819 . . . . 62.31 111.372 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 pt -81.66 -39.18 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 112.447 0.536 . . . . 74.53 112.447 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 44' ' ' MET . 31.2 mmtp -60.07 -53.79 61.7 Favored Pre-proline 0 N--CA 1.485 1.304 0 CA-C-O 118.004 -0.998 . . . . 71.4 112.518 -174.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 27.2 Cg_endo -60.17 -41.26 52.95 Favored 'Trans proline' 0 C--N 1.399 3.222 0 C-N-CA 122.08 1.853 . . . . 72.23 110.539 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.46 HD13 HD11 ' A' ' 45' ' ' LEU . 3.9 mm? -60.67 -35.66 76.8 Favored 'General case' 0 C--N 1.356 0.868 0 O-C-N 124.286 0.991 . . . . 75.21 111.667 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.16 -44.9 67.84 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.798 0.439 . . . . 73.43 110.943 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 36.2 mmt -57.13 -51.76 68.02 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.099 0.874 . . . . 74.34 110.265 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 41' ' ' PRO . 3.5 pp -77.16 -27.5 53.82 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.203 -0.453 . . . . 71.15 111.721 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -59.45 -39.14 82.64 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.654 0.661 . . . . 72.44 110.153 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 CA--C 1.544 0.723 0 CA-C-N 115.157 -0.929 . . . . 62.43 111.562 -177.78 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 p . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 110.321 -0.251 . . . . 64.21 110.321 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -57.09 -51.33 69.74 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.15 0.58 . . . . 71.12 110.918 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -72.25 -27.25 62.39 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.33 -0.85 . . . . 55.44 111.883 -179.169 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.547 HD13 HD11 ' A' ' 115' ' ' LEU . 52.8 tp -72.55 -43.6 63.25 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.885 -0.413 . . . . 71.44 109.885 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.3 m -62.17 -49.68 74.85 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 123.787 0.835 . . . . 74.11 109.36 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 54.8 m -54.71 -44.93 73.89 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.038 0.935 . . . . 74.13 110.826 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.89 -38.57 89.09 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.634 0.774 . . . . 63.14 111.198 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.82 -30.44 66.87 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.914 0.485 . . . . 72.51 111.007 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -68.33 -45.99 71.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.039 0.536 . . . . 74.11 109.87 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -67.91 -39.38 83.58 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.469 -0.787 . . . . 73.53 111.32 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.415 ' CZ ' HD13 ' A' ' 38' ' ' LEU . 1.2 t80 -68.47 -46.42 69.81 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.154 0.982 . . . . 71.1 109.531 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -60.94 -44.83 96.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.894 1.278 . . . . 73.41 111.036 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.3 -38.47 90.31 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.235 0.614 . . . . 74.42 111.083 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.571 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.85 -33.93 76.68 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.335 -0.848 . . . . 51.22 110.947 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.74 -35.82 75.31 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.944 -0.571 . . . . 73.14 110.994 174.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.07 -38.56 91.51 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 122.951 0.5 . . . . 71.11 110.981 176.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.24 -51.4 67.91 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 123.959 0.787 . . . . 74.3 109.943 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.63 -35.85 79.08 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.597 0.759 . . . . 62.41 111.537 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -69.05 -41.58 77.45 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.773 1.229 . . . . 53.42 110.358 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.08 -33.8 65.04 Favored Glycine 0 C--N 1.347 1.171 0 CA-C-N 115.109 -0.951 . . . . 61.12 112.224 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -62.69 -50.85 69.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.089 0.556 . . . . 52.12 111.408 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.543 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -71.98 -28.01 28.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 112.231 0.456 . . . . 70.53 112.231 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.435 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 39.5 tt0 -62.83 -36.72 84.13 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.668 0.747 . . . . 52.42 109.583 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -77.8 -39.13 44.9 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 114.359 -1.291 . . . . 74.52 110.698 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 15.1 m-30 -76.59 -3.52 38.06 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 124.309 1.044 . . . . 61.51 112.081 -177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.4 p -56.04 -31.36 63.06 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 121.507 0.67 . . . . 70.34 109.765 171.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.21 104.64 16.56 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.438 -1.319 . . . . 73.41 107.438 166.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -22.43 64.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.417 0.687 . . . . 70.25 110.724 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.7 m -58.62 -39.4 80.36 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.305 1.042 . . . . 65.3 110.966 170.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.13 -41.38 97.23 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 124.151 0.98 . . . . 64.24 110.818 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 29.0 mt -58.78 -51.17 75.35 Favored 'Isoleucine or valine' 0 C--N 1.362 1.11 0 O-C-N 123.956 0.785 . . . . 65.22 109.402 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 48.3 t -55.67 -46.18 77.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.88 0.872 . . . . 62.41 111.522 178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -59.32 -42.96 92.64 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.662 -1.154 . . . . 64.14 111.832 -176.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -24.89 27.48 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 119.305 -0.379 . . . . 73.34 110.513 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 16.5 tp -67.46 -39.27 85.32 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.493 0.717 . . . . 71.14 110.859 -172.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.8 t -65.81 -26.15 67.55 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 115.363 -0.835 . . . . 54.14 111.18 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.15 -3.99 30.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.157 0.983 . . . . 73.12 111.64 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 109.633 -0.506 . . . . 75.34 109.633 -175.415 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 108.858 -0.793 . . . . 74.21 108.858 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 98' ' ' PHE . 39.1 mt -61.95 -43.65 98.4 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.829 0.823 . . . . 72.24 110.41 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.4 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 12.7 m-85 -105.58 45.31 0.98 Allowed 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.143 -1.39 . . . . 73.01 108.933 -177.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.15 -66.72 0.35 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 118.483 0.583 . . . . 72.52 110.35 -170.712 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 36.1 t70 -73.07 -41.04 64.55 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.713 0.633 . . . . 74.13 111.028 -176.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.42 -58.56 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 123.839 0.712 . . . . 75.4 110.902 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -74.95 -20.79 59.53 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.979 0.912 . . . . 61.33 111.274 -176.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -64.42 -37.12 86.42 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 108.936 -0.765 . . . . 74.3 108.936 167.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 61.1 mtpt -71.75 -37.01 70.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.2 0.6 . . . . 73.11 110.721 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.571 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -58.35 -47.44 83.78 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.938 -0.393 . . . . 74.14 109.938 171.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.796 ' HB2' HH12 ' A' ' 34' ' ' ARG . 35.1 t -66.55 -38.97 88.25 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.744 0.818 . . . . 75.44 111.362 -177.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.749 ' HA ' ' HE3' ' A' ' 110' ' ' LYS . 39.1 t70 -69.4 -55.46 10.28 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.007 0.923 . . . . 55.51 110.197 -175.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.44 -22.84 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-N 115.22 -0.9 . . . . 64.13 110.598 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -70.56 -38.14 74.1 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 118.907 -0.568 . . . . 71.34 111.153 171.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' A' ' 107' ' ' ASP . 10.0 mtmp? -58.92 -47.3 85.49 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 118.536 0.607 . . . . 72.21 110.085 172.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 12.6 mm-40 -58.02 -49.87 75.37 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.329 1.018 . . . . 72.53 110.332 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.8 OUTLIER -54.75 -61.72 2.13 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 124.258 0.974 . . . . 54.32 109.727 176.521 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -53.47 -39.59 64.63 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.541 1.136 . . . . 65.55 112.091 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.56 -60.41 3.38 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.969 0.507 . . . . 71.24 111.125 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.547 HD11 HD13 ' A' ' 58' ' ' LEU . 4.1 pp -65.26 -37.16 86.36 Favored 'General case' 0 CA--C 1.559 1.297 0 CA-C-O 120.877 0.37 . . . . 51.43 111.492 -173.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.649 HD22 ' SD ' ' A' ' 122' ' ' MET . 95.1 mt -65.39 -49.11 70.52 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.185 0.994 . . . . 61.41 111.131 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -73.83 -40.06 63.6 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 112.454 0.538 . . . . 62.44 112.454 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 78.9 t -71.5 -53.56 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 122.582 0.353 . . . . 71.12 111.06 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -87.66 -57.68 2.85 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.079 0.466 . . . . 54.4 111.284 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 22.5 mt-30 -84.66 -13.2 52.2 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.348 -0.842 . . . . 65.03 111.336 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 60.82 35.32 19.47 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 124.765 1.226 . . . . 74.23 112.016 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.649 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.4 mtp -78.06 112.77 27.76 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 115.262 -0.881 . . . . 75.33 109.952 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo . . . . . 0 C--N 1.369 1.647 0 C-N-CA 122.703 2.269 . . . . 62.45 110.637 -179.094 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.406 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.871 0 N-CA-C 111.752 0.279 . . . . 74.11 111.752 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.42 -40.37 57.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.325 0.65 . . . . 40.21 111.282 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -64.24 -39.26 93.59 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.791 0.836 . . . . 71.31 110.668 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -52.16 -57.05 10.81 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 124.6 1.188 . . . . 75.21 110.881 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -69.25 -35.71 76.39 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 124.343 1.027 . . . . 71.35 113.542 -171.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.1 -37.56 69.53 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 118.558 0.617 . . . . 72.44 111.049 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -75.73 -36.35 59.95 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.417 0.627 . . . . 64.42 110.517 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 143' ' ' GLU . 14.2 t70 -62.18 -48.49 79.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.235 1.414 . . . . 75.33 109.838 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.479 ' HB2' HE22 ' A' ' 27' ' ' GLN . . . -74.86 -24.34 58.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.235 -1.348 . . . . 72.31 112.205 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.97 -45.76 93.46 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.861 -0.792 . . . . 44.24 108.861 168.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 140' ' ' ASP . 22.2 mm-40 -57.9 -54.16 50.08 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.182 -0.917 . . . . 75.04 111.291 175.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -62.09 -45.44 93.49 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 123.783 0.677 . . . . 72.54 112.5 -176.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -56.59 -54.3 47.53 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.768 0.827 . . . . 73.23 110.886 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -71.9 -30.22 65.14 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.834 -0.621 . . . . 62.32 111.308 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.47 -25.4 59.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.089 0.556 . . . . 72.02 110.957 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -57.8 3.59 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.263 0.625 . . . . 64.24 109.585 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.72 -52.14 64.42 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.352 -0.84 . . . . 64.22 110.65 -175.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 96.0 mmm -100.62 79.33 2.08 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.542 -1.281 . . . . 65.51 107.542 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 31.5 tp . . . . . 0 CA--C 1.536 0.406 0 CA-C-N 115.375 -0.829 . . . . 72.22 109.65 -178.924 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.128 -0.323 . . . . 75.32 110.128 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -70.44 -55.47 8.93 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.701 -0.851 . . . . 73.21 108.701 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.07 -32.21 70.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.145 0.903 . . . . 72.23 112.153 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -61.48 -53.37 57.28 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 109.398 -0.593 . . . . 64.31 109.398 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -67.66 -36.45 80.75 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 123.828 0.705 . . . . 71.02 111.469 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.0 mt -56.89 -54.14 33.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.813 0.845 . . . . 54.14 110.843 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 42.1 mm -67.21 -38.97 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 115.085 -0.961 . . . . 70.23 110.94 -177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.0 m -62.61 -47.39 83.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.279 0.632 . . . . 71.03 110.552 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.11 -60.63 3.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.659 0.783 . . . . 63.51 110.09 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.78 -41.22 95.85 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 124.515 1.134 . . . . 41.24 113.898 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.436 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 5.9 tp-100 -61.03 -56.15 24.36 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.649 -0.5 . . . . 73.54 109.649 178.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 85.3 t -62.98 -27.65 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 CA-C-N 115.263 -0.88 . . . . 75.13 111.393 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 69' ' ' LEU . 27.7 mt -60.93 -54.14 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.751 0.82 . . . . 64.44 109.618 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -58.15 -39.97 80.17 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 124.091 0.869 . . . . 74.11 110.508 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.436 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.4 mptm? -61.52 -51.43 68.65 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 123.826 0.704 . . . . 51.34 112.408 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 14.7 ptp180 -81.81 -15.71 53.27 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.411 0.523 . . . . 75.11 112.411 -176.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.619 ' SG ' HD23 ' A' ' 31' ' ' LEU . 45.4 t -69.69 -23.52 63.45 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.355 0.662 . . . . 71.24 110.829 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -65.17 -11.06 36.44 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.772 0.429 . . . . 72.51 112.127 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -30.58 71.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.47 0.708 . . . . 54.45 111.849 173.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.2 mmt -67.91 89.42 0.28 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.154 0.502 . . . . 65.44 111.401 -172.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.61 -20.26 61.32 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.709 -1.132 . . . . 74.1 110.574 169.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.6 m-85 -121.19 147.82 45.09 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.362 1.065 . . . . 63.35 108.396 177.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.615 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 96.8 m 59.09 59.06 2.88 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 124.812 1.32 . . . . 75.14 110.337 -166.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 26' ' ' LYS . 44.1 pttt -70.29 -40.14 74.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.174 -1.376 . . . . 72.14 111.782 -174.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 25' ' ' LYS . 60.1 tttm -78.02 -34.83 50.48 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.37 0.268 . . . . 73.15 110.305 -170.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -76.1 -25.48 55.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.339 0.656 . . . . 63.32 111.023 174.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 38.4 t -69.7 -44.27 70.73 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.743 0.817 . . . . 35.43 110.766 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.84 -33.3 70.52 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.635 0.774 . . . . 73.32 110.484 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.78 -44.33 93.71 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.56 0.744 . . . . 75.13 110.009 175.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.619 HD23 ' SG ' ' A' ' 18' ' ' CYS . 25.5 tp -59.1 -44.88 91.99 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 109.111 -0.699 . . . . 64.32 109.111 172.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.93 -47.53 88.32 Favored Glycine 0 C--N 1.353 1.486 0 O-C-N 124.148 0.905 . . . . 71.34 113.533 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -66.2 -39.68 89.83 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.181 0.592 . . . . 71.34 111.268 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.57 HH12 ' HB2' ' A' ' 106' ' ' SER . 36.5 mtt180 -61.3 -62.01 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.408 0.443 . . . . 72.04 110.478 174.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 64.9 t -53.88 -41.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.627 1.171 . . . . 45.44 112.225 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 39' ' ' ILE . 95.9 mt -68.64 -39.82 80.55 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.516 0.326 . . . . 73.42 110.611 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.07 -19.26 65.72 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-N 116.744 -0.207 . . . . 50.12 113.151 173.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 34' ' ' ARG . 5.2 mp -84.41 -53.53 5.39 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.452 1.101 . . . . 71.43 111.103 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 36' ' ' LEU . 15.2 pt -83.69 -42.81 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 118.404 -0.808 . . . . 70.52 112.328 -168.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 44' ' ' MET . 55.1 mtmt -52.41 -53.23 55.48 Favored Pre-proline 0 N--CA 1.49 1.552 0 CA-C-O 118.116 -0.945 . . . . 73.04 112.853 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.73 -43.22 51.85 Favored 'Trans proline' 0 C--N 1.398 3.146 0 C-N-CA 122.175 1.917 . . . . 74.44 111.7 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.15 -29.08 67.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.322 -0.853 . . . . 70.51 112.081 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 51.1 mt-10 -76.0 -38.06 57.76 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.661 0.785 . . . . 71.34 110.474 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 26.4 mmt -62.63 -36.31 82.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.596 -0.729 . . . . 74.5 110.111 177.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -80.6 -33.73 35.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.719 0.808 . . . . 70.3 111.042 176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.02 -32.93 74.7 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.563 1.145 . . . . 75.03 111.223 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.5 t70 . . . . . 0 C--N 1.357 0.901 0 O-C-N 124.046 0.842 . . . . 74.33 110.886 -179.599 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 109.605 -0.517 . . . . 71.44 109.605 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.51 -39.47 83.95 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.083 0.553 . . . . 54.52 111.681 -174.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -71.41 -36.03 71.2 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.673 0.789 . . . . 74.21 111.807 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.54 -46.07 87.67 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.211 -1.033 . . . . 64.14 108.211 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.5 m -69.28 -40.27 77.84 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 114.348 -1.296 . . . . 74.44 110.873 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.6 m -60.32 -43.15 96.65 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.268 0.627 . . . . 70.23 110.811 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.64 88.97 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 123.778 0.673 . . . . 54.42 109.998 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.459 ' SD ' HD11 ' A' ' 112' ' ' LEU . 26.3 mmt -64.27 -25.07 67.89 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.266 -0.879 . . . . 74.23 112.362 176.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.54 -44.13 29.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.287 0.635 . . . . 73.31 110.693 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -59.18 -45.09 91.94 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.875 0.734 . . . . 74.45 109.401 175.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -61.18 -50.76 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 113.245 -1.798 . . . . 63.35 110.746 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -58.56 -48.65 80.22 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.939 1.296 . . . . 75.14 110.624 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.28 -39.39 93.84 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.351 0.661 . . . . 74.2 111.743 -177.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -69.72 -34.3 73.69 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.707 -0.679 . . . . 72.22 110.911 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.5 ' O ' HD11 ' A' ' 14' ' ' ILE . 89.8 mt -69.48 -34.09 73.84 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.732 0.413 . . . . 72.03 110.74 174.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.77 -40.57 97.0 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.834 0.35 . . . . 74.51 110.751 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.88 -39.97 87.67 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.67 -0.695 . . . . 65.21 111.175 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.26 -39.32 89.39 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.258 0.623 . . . . 75.42 110.998 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -62.43 -44.56 96.13 Favored 'General case' 0 C--N 1.351 0.65 0 O-C-N 124.565 1.166 . . . . 73.52 109.38 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.6 -36.8 93.82 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.781 -0.645 . . . . 72.52 112.957 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.34 -52.93 63.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.69 0.396 . . . . 74.01 110.884 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.409 HG23 ' CE2' ' A' ' 98' ' ' PHE . 0.3 OUTLIER -66.75 -26.48 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 112.73 0.641 . . . . 73.42 112.73 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.35 -36.02 82.32 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.087 0.47 . . . . 63.52 111.163 170.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -76.74 -38.56 54.0 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.733 0.813 . . . . 73.13 111.024 175.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.18 -0.86 37.92 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.871 0.868 . . . . 73.23 113.033 -173.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 p -58.2 -29.28 65.55 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.054 0.454 . . . . 33.31 110.608 169.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -82.29 110.35 17.38 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 115.086 -0.961 . . . . 51.13 108.76 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -69.85 -31.73 69.73 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.775 0.83 . . . . 75.54 111.122 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.0 p -67.73 -37.85 82.74 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.151 0.98 . . . . 52.12 111.18 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -61.76 -38.48 88.17 Favored 'General case' 0 C--O 1.25 1.114 0 C-N-CA 123.456 0.702 . . . . 75.25 111.05 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.496 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 22.6 mt -59.84 -49.7 82.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 CA-C-N 115.529 -0.759 . . . . 64.3 109.724 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.8 t -62.15 -35.06 77.63 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.222 0.609 . . . . 64.43 111.562 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -64.33 -47.72 78.31 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 124.055 0.847 . . . . 72.35 111.268 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.77 -32.44 59.94 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 110.002 -0.369 . . . . 71.44 110.002 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 9.7 tp -61.96 -50.62 71.39 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 124.184 0.994 . . . . 73.04 110.033 -174.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -61.23 -29.01 69.57 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 115.932 -0.576 . . . . 75.14 112.25 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.2 -54.48 6.44 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.355 0.662 . . . . 60.22 111.356 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 CA--C 1.546 0.789 0 C-N-CA 123.61 0.764 . . . . 74.44 109.622 -178.452 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.496 HG13 ' HB2' ' A' ' 141' ' ' ALA . 3.0 mp . . . . . 0 CA--C 1.552 1.024 0 N-CA-C 107.551 -1.277 . . . . 75.12 107.551 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -55.8 -31.4 62.61 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.855 0.862 . . . . 61.34 112.049 -173.539 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.415 ' CZ ' HD22 ' A' ' 31' ' ' LEU . 91.2 m-85 -125.57 25.54 6.97 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.107 -0.949 . . . . 71.11 110.694 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.28 -64.02 0.35 Allowed 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 125.488 1.515 . . . . 63.13 113.607 -163.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -67.31 -48.87 66.32 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.129 0.972 . . . . 73.52 111.553 -170.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.06 -43.38 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 114.765 -1.107 . . . . 65.44 110.875 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.519 ' HA ' ' HB2' ' A' ' 105' ' ' LEU . 67.3 t30 -78.34 -18.32 55.32 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.986 1.315 . . . . 73.35 110.212 -176.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.05 -39.78 72.07 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.746 -1.205 . . . . 61.43 107.746 168.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.73 -39.69 94.07 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.516 0.51 . . . . 72.41 110.523 170.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 102' ' ' ASN . 9.4 mp -60.07 -43.92 95.11 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 109.766 -0.457 . . . . 73.33 109.766 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.57 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.4 t -66.04 -47.5 74.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.116 0.566 . . . . 70.13 110.789 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.35 -57.35 7.65 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.642 1.177 . . . . 75.2 110.966 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.8 t -63.52 -39.85 86.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-N 115.566 -0.743 . . . . 72.04 111.258 -177.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.2 t-105 -69.37 -39.05 78.29 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-O 118.543 -0.741 . . . . 73.41 111.88 -178.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -38.47 83.63 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 119.4 1.0 . . . . 72.42 110.534 175.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -60.5 -46.58 89.58 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.03 0.532 . . . . 73.25 110.903 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 8.4 tt -70.39 -48.2 57.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.595 1.158 . . . . 73.41 109.936 -172.491 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.1 p -65.63 -43.1 90.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.724 0.81 . . . . 73.0 110.891 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.7 mt -68.87 -35.33 76.77 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.234 -0.413 . . . . 72.42 112.041 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.67 -21.78 59.23 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-N 118.705 0.684 . . . . 75.43 110.896 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.0 mt -70.93 -35.33 72.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.916 -0.401 . . . . 65.24 109.916 167.648 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 21.5 mm-40 -71.55 -29.81 65.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.73 0.812 . . . . 53.24 111.662 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 t -85.2 -62.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 122.728 0.411 . . . . 65.02 110.957 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -75.93 -56.14 4.95 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.203 0.601 . . . . 73.15 111.687 -170.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -85.12 -18.24 34.83 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.177 0.591 . . . . 74.12 110.808 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 61.52 16.22 7.41 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.63 1.572 . . . . 74.55 112.798 -177.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 36.6 mtm -71.84 140.83 83.94 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.522 -0.547 . . . . 73.32 109.522 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 C--N 1.371 1.747 0 C-N-CA 123.499 2.799 . . . . 51.42 112.813 -176.748 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.9 m0 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 113.077 0.769 . . . . 74.3 113.077 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.44 -37.11 82.48 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 122.785 0.434 . . . . 44.34 111.877 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -74.58 -43.58 54.95 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.904 0.482 . . . . 74.14 111.269 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.07 -53.71 49.46 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.502 0.721 . . . . 61.4 110.976 -174.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.83 -29.73 68.46 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.541 0.737 . . . . 74.21 112.461 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -71.52 -45.25 62.9 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 123.757 0.661 . . . . 74.03 110.729 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -68.27 -35.75 78.37 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.026 -0.533 . . . . 73.31 110.548 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.47 -45.0 81.17 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.39 -0.823 . . . . 74.31 109.043 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.496 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -57.69 -40.89 80.47 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 124.272 0.982 . . . . 62.24 111.181 178.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.77 -60.6 3.27 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 124.084 0.865 . . . . 72.43 110.903 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.76 -46.73 86.8 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.261 1.024 . . . . 74.24 111.689 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -78.58 -27.22 45.64 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.185 -1.371 . . . . 64.42 110.84 -170.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -61.68 -47.8 83.68 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 115.939 -0.573 . . . . 73.4 109.681 167.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -62.84 -37.3 86.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.766 0.666 . . . . 54.15 110.688 176.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.45 -20.91 62.86 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.779 0.675 . . . . 75.1 111.684 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.615 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -84.85 -62.45 1.54 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.804 0.275 . . . . 73.5 110.552 172.225 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -68.26 -24.3 64.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.432 1.093 . . . . 64.43 111.485 -166.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 44.0 ttm -139.57 83.22 1.92 Allowed 'General case' 0 C--O 1.24 0.554 0 N-CA-C 107.378 -1.342 . . . . 65.31 107.378 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.545 0.755 0 CA-C-N 115.614 -0.721 . . . . 75.02 109.303 -172.773 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 111.559 0.207 . . . . 63.11 111.559 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.19 -57.35 11.49 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.604 1.162 . . . . 64.44 108.776 171.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.94 -44.25 97.15 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 114.961 -1.018 . . . . 72.51 110.5 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -58.31 -51.19 70.84 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.571 0.545 . . . . 73.43 111.07 -175.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 22.0 m-70 -67.9 -52.1 40.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.032 0.533 . . . . 72.31 111.182 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.8 mt -53.61 -50.21 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 124.12 0.968 . . . . 74.52 111.86 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.455 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 99.6 mt -63.68 -46.44 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.545 -0.74 . . . . 74.32 109.667 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -51.63 -44.17 62.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 123.754 0.659 . . . . 52.21 110.571 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 84.6 mt -59.85 -50.9 71.99 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.729 0.643 . . . . 74.3 110.307 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.78 -33.82 87.0 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 124.385 1.053 . . . . 62.21 113.629 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 19.3 mm-40 -64.9 -52.79 54.59 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.668 -0.864 . . . . 71.54 108.668 176.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.71 -34.63 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.354 1.062 . . . . 53.44 110.946 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.71 -51.6 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 123.983 0.913 . . . . 74.24 109.736 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -64.06 -36.4 83.88 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.815 0.697 . . . . 73.54 110.346 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.1 mmmt -79.65 -29.05 40.84 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.352 0.661 . . . . 65.34 112.653 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 20' ' ' GLU . 11.6 ptm180 -87.98 -20.97 25.14 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.219 -0.301 . . . . 71.24 110.756 174.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 36.5 t -74.05 -20.26 60.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.781 0.832 . . . . 51.22 110.927 175.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -48.85 -36.43 16.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.832 0.853 . . . . 75.4 112.402 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HB2' ' NH2' ' A' ' 82' ' ' ARG . 12.8 pt-20 -76.83 -3.37 38.1 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.464 0.913 . . . . 75.13 113.464 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 18.6 mmt -74.98 83.91 2.25 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.64 -0.504 . . . . 63.22 109.64 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -70.1 -36.45 74.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.929 -0.767 . . . . 73.33 108.929 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -95.86 158.26 15.53 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.743 -1.117 . . . . 73.34 109.215 168.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.677 ' SG ' HG21 ' A' ' 85' ' ' ILE . 91.8 m 56.51 58.96 3.84 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 124.237 0.961 . . . . 74.44 109.934 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -70.53 -49.4 48.56 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 113.675 -1.602 . . . . 72.22 110.379 -171.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 52.4 mttm -70.58 -38.93 74.14 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.995 -174.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.27 -26.34 61.95 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.29 0.636 . . . . 74.11 111.337 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 49.7 t -69.46 -37.48 77.33 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.42 0.688 . . . . 74.54 110.311 170.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.89 -34.23 68.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.548 -0.751 . . . . 74.52 110.573 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 26' ' ' LYS . 29.0 mmt180 -69.2 -60.58 2.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.913 0.485 . . . . 73.2 109.985 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.7 tp -54.79 -49.35 71.16 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.857 0.723 . . . . 75.1 110.146 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.11 -55.48 30.09 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 124.059 0.849 . . . . 74.3 113.548 -176.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -67.94 -36.83 80.81 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.882 0.873 . . . . 74.43 110.996 -175.069 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.504 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 42.3 mtt-85 -63.42 -62.41 1.7 Allowed 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.822 0.701 . . . . 74.3 110.704 176.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 87.1 t -54.06 -46.76 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.041 0.936 . . . . 73.31 110.989 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.92 -38.43 90.96 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.228 -0.896 . . . . 54.54 109.708 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -75.71 -13.24 83.21 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 115.539 -0.755 . . . . 71.45 113.738 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 65.6 mt -84.09 -44.93 13.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.137 0.575 . . . . 75.24 110.003 174.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 pt -85.97 -24.43 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-N 115.498 -0.774 . . . . 71.4 112.407 -172.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -62.05 -47.28 91.1 Favored Pre-proline 0 N--CA 1.497 1.899 0 N-CA-C 112.899 0.703 . . . . 73.12 112.899 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.65 -51.48 11.02 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 121.758 1.639 . . . . 60.11 110.447 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.07 -19.61 64.89 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.296 -0.866 . . . . 52.24 111.772 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -68.1 -55.34 12.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.351 0.66 . . . . 63.2 110.013 174.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 50.7 mtm -64.65 -35.31 80.62 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.908 -1.042 . . . . 73.32 110.166 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 122' ' ' MET . 68.3 mt -82.02 -18.92 41.63 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.76 1.224 . . . . 74.32 111.838 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -75.43 -43.1 51.53 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.454 -0.572 . . . . 72.32 109.454 172.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 . . . . . 0 N--CA 1.478 0.96 0 CA-C-N 114.788 -1.096 . . . . 65.42 110.231 177.066 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 110.495 -0.187 . . . . 73.24 110.495 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.14 -34.48 68.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.193 0.597 . . . . 71.33 110.136 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -59.35 -51.49 69.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.819 0.848 . . . . 72.4 110.27 170.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.576 HD22 HD13 ' A' ' 115' ' ' LEU . 0.7 OUTLIER -54.96 -46.36 75.02 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.427 -1.26 . . . . 64.52 110.26 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 94.2 m -58.68 -46.83 86.37 Favored 'General case' 0 C--N 1.356 0.863 0 C-N-CA 124.025 0.93 . . . . 73.14 110.537 -178.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.1 m -61.88 -50.26 72.95 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.982 0.801 . . . . 71.12 110.352 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 64' ' ' ARG . . . -59.78 -40.47 88.35 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.949 0.899 . . . . 52.11 111.407 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.436 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.4 mmt -66.58 -35.59 80.59 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.481 -0.781 . . . . 75.11 110.842 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -71.7 -35.66 70.31 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.278 0.631 . . . . 62.22 111.039 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 61' ' ' ALA . 66.8 mtp85 -68.38 -41.13 81.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.072 0.949 . . . . 73.41 110.086 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.409 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 t80 -71.93 -41.2 68.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.64 -1.163 . . . . 73.25 110.023 -177.483 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 1.2 tmtp? -59.78 -48.35 82.02 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.092 1.357 . . . . 72.4 109.066 175.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -61.52 -40.66 95.44 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 124.538 1.149 . . . . 54.5 110.909 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.646 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -64.37 -36.1 83.04 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.698 0.799 . . . . 64.32 110.747 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -73.06 -27.69 61.88 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.282 0.633 . . . . 64.51 111.57 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 13.1 mm-40 -64.72 -41.55 95.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.338 -0.616 . . . . 75.54 109.338 172.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 5.0 mm-40 -59.48 -49.01 79.46 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-N 115.119 -0.946 . . . . 73.3 110.333 177.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.52 -47.48 85.38 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.957 0.786 . . . . 71.51 111.572 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.88 -48.75 80.3 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 124.4 1.063 . . . . 53.22 111.174 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.41 ' O ' ' HG2' ' A' ' 78' ' ' LYS . . . -61.35 -38.74 96.21 Favored Glycine 0 C--N 1.351 1.378 0 O-C-N 124.026 0.829 . . . . 31.41 112.815 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -62.89 -56.78 14.25 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 118.765 -0.636 . . . . 70.14 111.135 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.566 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.8 OUTLIER -63.49 -23.06 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 122.756 0.423 . . . . 75.23 112.053 177.76 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.47 -38.05 80.71 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.675 0.39 . . . . 63.32 110.262 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 74' ' ' GLY . 31.5 mmtp -83.9 -29.5 27.13 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.453 0.301 . . . . 70.44 111.129 176.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.566 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.8 m-85 -77.46 -8.52 57.88 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.319 1.048 . . . . 62.13 111.335 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.1 p -56.37 -30.41 62.64 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.214 0.606 . . . . 74.24 109.889 171.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -81.21 102.13 10.14 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.54 -1.281 . . . . 71.33 107.54 165.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.616 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.6 mpt_? -70.32 -24.89 63.09 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.749 0.82 . . . . 63.43 110.535 -175.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 72.4 p -66.89 -40.98 87.93 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.947 0.899 . . . . 44.33 110.478 172.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -57.86 -42.29 84.2 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.011 0.924 . . . . 74.12 110.65 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.677 HG21 ' SG ' ' A' ' 24' ' ' CYS . 15.7 mt -58.81 -57.45 11.16 Favored 'Isoleucine or valine' 0 C--N 1.356 0.889 0 CA-C-N 115.323 -0.853 . . . . 75.24 109.379 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.4 t -53.77 -37.09 63.08 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.766 0.827 . . . . 53.44 112.146 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -60.67 -45.71 93.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.832 1.253 . . . . 75.1 111.277 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -25.95 29.65 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.408 0.147 . . . . 70.11 110.78 176.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.464 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 13.4 tp -78.01 -29.21 49.42 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.572 0.749 . . . . 71.11 111.635 -167.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -72.76 -26.62 61.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.114 0.566 . . . . 71.41 110.214 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.13 -37.27 20.42 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.018 0.927 . . . . 74.14 110.369 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.2 p . . . . . 0 CA--C 1.543 0.682 0 C-N-CA 123.108 0.563 . . . . 63.23 110.384 -178.415 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.3 mm . . . . . 0 CA--C 1.544 0.716 0 N-CA-C 107.923 -1.139 . . . . 64.1 107.923 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.3 mp -45.33 -38.52 5.84 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.198 0.999 . . . . 63.21 112.488 -177.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.44 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 61.4 m-85 -125.65 39.31 3.99 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 123.924 0.89 . . . . 65.52 109.797 -177.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -56.55 -58.47 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.755 0.707 . . . . 74.04 111.399 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.32 -47.89 53.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.523 1.129 . . . . 72.11 110.229 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.71 -63.53 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.605 0 O-C-N 124.372 1.045 . . . . 71.15 110.933 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.426 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 43.6 t30 -65.9 -28.03 68.64 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.774 1.23 . . . . 74.11 111.475 -176.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -57.66 -46.87 83.68 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 110.02 -0.363 . . . . 74.41 110.02 169.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -67.36 -32.55 73.56 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.189 0.596 . . . . 75.41 111.944 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -60.7 -47.92 84.09 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 110.012 -0.366 . . . . 72.41 110.012 171.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.7 m -68.46 -39.67 81.34 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.048 0.939 . . . . 44.04 111.323 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.536 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 9.5 t0 -68.0 -58.41 4.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.468 -1.242 . . . . 65.44 109.151 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.5 t -65.15 -33.93 67.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.449 -0.796 . . . . 73.12 110.348 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 49.3 t-105 -60.62 -44.09 96.73 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 119.187 -0.435 . . . . 74.53 111.479 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 19.1 pttm -64.61 -43.85 92.46 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.987 -0.745 . . . . 72.02 108.987 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.7 mt-10 -61.05 -42.57 98.73 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.696 0.799 . . . . 72.12 110.747 178.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.436 HD11 ' SD ' ' A' ' 62' ' ' MET . 7.0 tt -71.41 -48.47 49.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.966 1.306 . . . . 62.3 109.785 -171.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 39.3 t -61.0 -34.66 75.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.418 1.087 . . . . 74.21 110.922 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -63.9 -58.47 6.68 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 123.043 0.537 . . . . 75.4 111.502 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.576 HD13 HD22 ' A' ' 58' ' ' LEU . 2.0 pp -67.31 -20.26 65.58 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 118.569 0.622 . . . . 63.24 112.164 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.635 HD13 ' SD ' ' A' ' 122' ' ' MET . 46.7 mt -64.01 -55.27 23.54 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.747 0.419 . . . . 72.55 110.635 167.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -71.22 -26.49 62.96 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.052 0.389 . . . . 74.3 112.052 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 79.3 t -78.42 -54.33 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.418 0.687 . . . . 75.43 110.517 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -90.15 -59.14 2.27 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.075 0.398 . . . . 73.23 112.075 -172.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -77.25 -14.44 59.76 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 122.721 0.408 . . . . 74.3 110.944 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.14 54.69 6.61 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.904 1.281 . . . . 63.4 108.858 -175.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.635 ' SD ' HD13 ' A' ' 116' ' ' LEU . 51.0 ttm -92.24 131.0 35.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 108.414 -0.958 . . . . 71.3 108.414 174.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 2.7 Cg_exo . . . . . 0 C--N 1.371 1.753 0 C-N-CA 122.958 2.438 . . . . 74.41 113.61 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.435 ' HH2' HD21 ' A' ' 38' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 111.7 0.259 . . . . 73.33 111.7 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.11 -41.38 92.48 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.499 0.719 . . . . 72.33 111.216 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -72.03 -45.14 61.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.897 0.879 . . . . 71.5 111.464 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.441 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 19.0 mm-40 -50.1 -55.95 12.85 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.656 1.182 . . . . 64.12 111.449 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 -52.18 45.84 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 114.467 -1.242 . . . . 72.44 111.979 -174.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -60.74 -40.08 91.06 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 118.247 0.476 . . . . 74.42 111.289 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -53.16 19.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.409 0.684 . . . . 74.25 109.237 -177.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.89 -34.87 78.73 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.911 -1.04 . . . . 63.21 110.234 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.03 -31.93 66.64 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.103 0.961 . . . . 64.42 111.215 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -65.06 -47.26 77.97 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 123.738 0.649 . . . . 65.02 110.327 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.36 -33.8 75.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.768 -0.651 . . . . 71.12 111.593 174.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.7 t0 -72.58 -41.96 65.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.231 1.012 . . . . 71.24 111.521 -178.189 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.464 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 26.8 ttp85 -60.76 -43.23 98.27 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 114.855 -1.066 . . . . 74.41 109.128 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 13.7 ttp-105 -66.71 -33.92 76.7 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.972 -1.013 . . . . 74.41 111.548 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.4 -27.61 66.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.452 0.301 . . . . 53.43 111.101 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -47.64 10.57 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.198 0.599 . . . . 75.32 110.653 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -80.99 -41.63 22.44 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.67 0.788 . . . . 74.02 112.43 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 49.1 ttm -76.73 -61.0 2.11 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.515 -1.291 . . . . 74.34 107.515 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 18.5 tp . . . . . 0 N--CA 1.487 1.398 0 C-N-CA 124.705 1.202 . . . . 75.24 112.207 175.272 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 108.2 -1.037 . . . . 75.01 108.2 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.549 ' HA ' ' HD2' ' A' ' 66' ' ' LYS . 5.1 p30 -55.76 -43.99 77.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.471 -1.24 . . . . 61.52 111.14 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.455 ' O ' HG12 ' A' ' 8' ' ' ILE . 29.2 mt -65.55 -33.44 75.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.529 0.731 . . . . 72.41 111.789 175.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 tmtp? -60.7 -44.92 95.97 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 107.973 -1.121 . . . . 75.24 107.973 177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -68.72 -40.14 80.08 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.858 -0.61 . . . . 74.1 111.915 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.45 HD12 HD23 ' A' ' 4' ' ' LEU . 83.9 mt -58.9 -53.14 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.394 0.678 . . . . 51.33 110.612 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.756 HG23 ' HG2' ' A' ' 43' ' ' GLU . 30.6 mm -70.29 -53.68 22.0 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-N 115.413 -0.812 . . . . 71.04 110.806 -174.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 92.1 m -60.41 -58.96 6.27 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 123.834 0.709 . . . . 72.32 110.848 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 14' ' ' ILE . 95.0 mt -66.48 -32.41 73.76 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 118.644 -0.693 . . . . 73.5 111.748 -175.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -63.09 -43.01 99.39 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 121.387 -0.435 . . . . 65.31 112.473 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.02 -38.77 79.39 Favored 'General case' 0 CA--C 1.552 1.026 0 O-C-N 122.427 -0.455 . . . . 72.04 110.647 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.5 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 73.0 t -64.32 -34.85 71.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.554 0.742 . . . . 72.01 110.386 175.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.472 HG21 HG21 ' A' ' 35' ' ' VAL . 54.8 mt -56.85 -52.81 50.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.669 0.787 . . . . 71.32 109.152 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -58.96 -33.05 70.19 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 123.998 0.811 . . . . 74.12 111.522 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -67.48 -57.65 6.15 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.549 0.739 . . . . 55.2 112.023 176.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 15.0 ptp180 -82.53 -15.55 51.96 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 113.015 0.746 . . . . 75.13 113.015 -172.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.605 ' SG ' HD23 ' A' ' 31' ' ' LEU . 49.2 t -68.98 -28.37 66.55 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.097 0.408 . . . . 72.11 111.967 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -5.26 58.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.458 0.303 . . . . 65.14 111.71 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.86 -39.43 89.12 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 123.412 0.685 . . . . 53.11 109.608 172.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 80' ' ' SER . 3.3 mpp? -64.7 104.29 0.8 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.389 -0.823 . . . . 75.51 109.658 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -31.78 71.15 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.526 0.73 . . . . 75.55 109.398 172.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.483 ' O ' ' HB3' ' A' ' 21' ' ' MET . 87.2 m-85 -91.89 169.68 10.48 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.577 -1.192 . . . . 74.51 109.017 170.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.648 ' SG ' HG21 ' A' ' 85' ' ' ILE . 56.7 m 56.41 56.24 5.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.255 1.026 . . . . 63.53 110.204 -172.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.87 -47.13 66.68 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.564 -1.653 . . . . 73.12 109.961 -174.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.563 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.1 mtpm? -82.0 -17.72 45.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.889 -1.05 . . . . 74.52 109.824 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.667 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 10.7 mm-40 -70.62 -38.82 73.98 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 110.324 -0.25 . . . . 73.14 110.324 168.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.546 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 52.5 t -67.52 -32.92 74.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.843 0.715 . . . . 70.41 110.041 174.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -62.44 -62.98 1.38 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.772 0.429 . . . . 74.32 111.854 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.408 HH12 ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -60.6 -41.21 94.29 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.627 0.371 . . . . 75.44 111.875 -176.662 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.605 HD23 ' SG ' ' A' ' 18' ' ' CYS . 60.1 tp -65.24 -59.61 3.88 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.586 0.354 . . . . 60.42 110.074 179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.48 -40.77 92.77 Favored Glycine 0 C--N 1.345 1.046 0 O-C-N 124.41 1.068 . . . . 70.51 113.459 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -65.69 -49.34 68.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.522 0.729 . . . . 55.44 111.102 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.547 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 55.3 mtt-85 -57.09 -58.41 8.31 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.859 0.725 . . . . 62.52 110.147 175.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.472 HG21 HG21 ' A' ' 14' ' ' ILE . 54.5 t -52.1 -45.99 42.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 124.048 0.939 . . . . 72.21 111.672 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.18 -45.75 93.32 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.438 0.461 . . . . 72.41 110.878 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.51 -24.45 69.4 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 123.164 0.29 . . . . 63.02 113.647 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.624 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 30.2 mt -85.86 -51.6 6.29 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 123.488 0.715 . . . . 73.54 111.401 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.441 HG21 ' HA3' ' A' ' 11' ' ' GLY . 17.0 pt -72.66 -40.81 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.422 -0.799 . . . . 74.25 111.214 -173.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 23.8 tptm -51.33 -50.54 75.53 Favored Pre-proline 0 N--CA 1.49 1.571 0 N-CA-C 113.778 1.029 . . . . 72.52 113.778 -170.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 51.0 Cg_exo -57.48 -41.57 70.49 Favored 'Trans proline' 0 C--N 1.387 2.595 0 C-N-CA 121.726 1.617 . . . . 62.34 112.569 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.98 -25.51 59.97 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.185 -0.916 . . . . 64.45 111.218 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.756 ' HG2' HG23 ' A' ' 8' ' ' ILE . 38.5 mt-10 -67.69 -44.03 78.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.034 0.934 . . . . 73.32 109.562 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.3 mmt -59.69 -47.35 85.97 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 124.701 1.25 . . . . 64.45 110.165 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.2 -30.92 63.85 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.716 0.806 . . . . 54.45 112.071 -177.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -74.53 -29.86 61.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.94 0.896 . . . . 74.25 109.679 177.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 123.623 0.769 . . . . 74.35 109.94 -179.94 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.13 -43.39 98.54 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.335 0.654 . . . . 74.11 110.485 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? -74.77 -21.97 59.03 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.831 -0.622 . . . . 73.33 112.147 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 115' ' ' LEU . 13.0 tp -81.22 -30.69 34.17 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.29 0.636 . . . . 72.21 110.316 174.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.8 m -63.45 -45.35 91.29 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.435 -0.95 . . . . 52.22 108.435 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.467 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 57.2 m -60.58 -44.25 96.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 124.401 1.063 . . . . 71.03 111.244 174.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.51 -42.99 98.46 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.6 0.76 . . . . 51.14 111.275 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.45 -30.67 69.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.164 0.586 . . . . 62.04 111.042 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -74.15 -32.92 63.33 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.133 0.573 . . . . 64.42 111.164 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.8 mtt180 -65.21 -47.1 78.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 109.143 -0.688 . . . . 73.33 109.143 175.59 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.624 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 4.5 t80 -65.51 -45.49 83.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.673 -1.603 . . . . 75.41 109.772 -175.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 34.4 tttm -49.67 -57.71 6.7 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 113.915 -1.493 . . . . 75.22 110.269 169.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -62.91 -31.47 72.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.704 0.802 . . . . 70.41 111.824 -176.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.589 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -70.0 -37.75 75.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.911 0.884 . . . . 73.21 111.164 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.03 -21.14 40.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.152 0.581 . . . . 75.52 110.541 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 78.1 mt-10 -72.55 -38.13 68.07 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.352 0.661 . . . . 61.13 110.05 171.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 48.3 mt-10 -64.67 -50.21 67.94 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.696 -0.684 . . . . 73.54 109.381 174.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -57.07 -48.18 79.2 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.279 0.987 . . . . 72.13 111.71 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -56.54 -42.73 78.98 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.436 1.085 . . . . 73.41 110.704 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.24 -36.49 89.84 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.646 0.592 . . . . 64.21 113.218 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.2 mm-40 -63.08 -55.51 24.83 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.941 -0.392 . . . . 71.32 109.941 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.3 pt -69.03 -20.18 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.366 0.666 . . . . 72.32 112.404 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -62.06 -46.66 88.15 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 122.973 0.509 . . . . 72.33 109.92 167.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -82.84 -24.33 33.35 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.349 0.5 . . . . 64.52 112.349 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.629 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.0 m-85 -81.18 -12.3 59.22 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.543 0.737 . . . . 74.42 111.239 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.611 ' HA ' ' SD ' ' A' ' 21' ' ' MET . 96.9 p -55.78 -28.71 57.49 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.669 0.606 . . . . 54.21 110.568 176.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.74 104.82 13.26 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.406 -1.331 . . . . 72.21 107.406 162.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -69.67 -23.73 63.5 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.728 0.811 . . . . 71.44 110.3 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -63.34 -35.87 81.81 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.16 -0.927 . . . . 74.5 111.884 174.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -58.55 -46.37 87.0 Favored 'General case' 0 C--O 1.256 1.44 0 C-N-CA 124.262 1.025 . . . . 75.53 109.795 175.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.648 HG21 ' SG ' ' A' ' 24' ' ' CYS . 30.7 mt -56.12 -57.43 8.56 Favored 'Isoleucine or valine' 0 C--N 1.356 0.877 0 CA-C-N 115.229 -0.896 . . . . 73.11 109.766 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.2 t -56.53 -34.9 67.48 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.358 1.036 . . . . 25.34 111.504 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -66.06 -45.37 81.57 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.529 0.732 . . . . 64.54 111.702 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.39 -22.81 32.64 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 121.122 -0.231 . . . . 74.41 110.418 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 tp -79.19 -29.44 42.9 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.934 0.894 . . . . 73.53 111.259 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -72.1 -17.2 62.0 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.84 -0.618 . . . . 61.32 110.873 176.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -121.49 16.43 11.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.66 1.184 . . . . 42.12 111.002 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 C--N 1.354 0.791 0 N-CA-C 109.55 -0.537 . . . . 64.32 109.55 179.735 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 96' ' ' ILE . 2.8 mp . . . . . 0 C--O 1.241 0.61 0 N-CA-C 109.561 -0.533 . . . . 63.22 109.561 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.667 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 5.8 tp -68.14 -41.99 80.78 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.034 0.933 . . . . 72.33 110.849 -175.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.438 ' CD1' ' HB3' ' A' ' 97' ' ' LEU . 69.8 m-85 -106.49 36.86 2.47 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 114.046 -1.434 . . . . 75.25 109.889 -175.512 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.61 -58.52 5.63 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.78 0.832 . . . . 74.52 112.781 -175.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.7 -49.84 69.29 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.393 -0.821 . . . . 74.42 111.219 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.79 -43.69 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 123.4 0.68 . . . . 75.24 111.006 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.492 HD21 ' NH1' ' A' ' 34' ' ' ARG . 33.0 t30 -71.16 -28.05 63.98 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.193 0.997 . . . . 72.34 110.516 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.39 -35.03 79.72 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.845 -0.798 . . . . 74.13 108.845 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -64.55 -53.48 47.17 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 109.796 -0.446 . . . . 73.32 109.796 168.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.589 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.7 mp -52.07 -38.45 57.19 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.034 0.534 . . . . 70.45 111.348 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.0 t -74.48 -56.62 4.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.326 0.65 . . . . 71.22 110.471 -175.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -53.9 -55.21 28.98 Favored 'General case' 0 C--O 1.257 1.466 0 C-N-CA 124.547 1.139 . . . . 71.44 110.715 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.2 t -65.62 -50.26 72.69 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 CA-C-N 113.547 -1.661 . . . . 60.1 110.84 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.54 -37.39 85.93 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 118.687 0.676 . . . . 72.22 111.478 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -56.69 -60.3 3.76 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.541 0.525 . . . . 64.51 109.764 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.45 -42.29 70.43 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 124.028 0.83 . . . . 73.32 111.315 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.01 -58.48 4.85 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.192 1.397 . . . . 74.35 110.156 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.2 p -59.09 -41.16 87.41 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.594 0.757 . . . . 63.43 111.602 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.19 -46.29 84.57 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.094 0.557 . . . . 72.1 112.286 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.822 HD11 HD13 ' A' ' 58' ' ' LEU . 4.2 pp -72.4 -22.94 61.05 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 122.271 -0.268 . . . . 64.15 110.706 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 122' ' ' MET . 88.1 mt -72.79 -36.01 67.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.402 0.681 . . . . 71.43 110.616 171.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -60.81 -38.72 86.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 75.45 109.756 171.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 97.2 t -68.99 -60.49 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.085 0 C-N-CA 123.53 0.732 . . . . 61.34 111.558 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.16 -60.93 2.16 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.622 0.769 . . . . 70.15 111.358 -172.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -93.63 -2.63 53.81 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 114.935 -1.03 . . . . 62.41 111.2 -166.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.34 15.78 7.96 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.307 1.043 . . . . 73.21 110.72 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.556 ' SD ' HD13 ' A' ' 116' ' ' LEU . 40.2 ttm -66.61 116.84 38.59 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 123.814 0.846 . . . . 55.35 110.334 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 C--N 1.373 1.855 0 C-N-CA 123.315 2.677 . . . . 65.52 113.231 -168.27 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 12.2 m0 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 113.006 0.743 . . . . 65.52 113.006 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.0 -48.95 41.04 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-O 120.821 0.343 . . . . 74.2 110.828 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -70.05 -35.85 74.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.471 -0.786 . . . . 75.2 112.019 -178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -60.67 -49.14 78.7 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.409 0.683 . . . . 73.44 111.191 -177.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -73.93 -39.78 63.57 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.731 -0.668 . . . . 72.33 112.011 -175.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -58.28 -59.0 6.0 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.618 -0.512 . . . . 73.14 109.618 176.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -52.7 -61.75 2.09 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 124.603 1.189 . . . . 54.14 111.095 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -50.74 65.16 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.077 -0.965 . . . . 74.45 111.489 -168.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.467 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -73.17 -28.9 62.48 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.813 0.696 . . . . 25.04 112.507 -172.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.18 -47.09 68.88 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.784 -0.45 . . . . 71.43 109.784 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.43 -37.06 85.83 Favored 'General case' 0 N--CA 1.484 1.25 0 O-C-N 123.915 0.759 . . . . 75.42 111.828 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 25.4 t0 -78.36 -42.92 29.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.94 0.896 . . . . 43.33 110.923 -171.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -63.6 -40.62 97.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 108.338 -0.986 . . . . 71.11 108.338 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -60.0 -46.89 88.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.043 0.937 . . . . 71.24 110.859 175.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.38 -23.22 60.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.343 0.657 . . . . 74.21 111.632 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.448 ' HE2' ' HG ' ' A' ' 24' ' ' CYS . 0.8 OUTLIER -73.04 -57.13 4.25 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.171 0.588 . . . . 65.33 109.462 178.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -74.33 -47.29 35.48 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.341 -0.845 . . . . 74.03 110.599 -173.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 38.5 ttm -89.35 73.46 7.96 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 107.151 -1.425 . . . . 74.42 107.151 168.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 17.5 tp . . . . . 0 CA--C 1.545 0.754 0 CA-C-N 115.069 -0.969 . . . . 72.02 109.8 -177.773 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 112.167 0.432 . . . . 72.12 112.167 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -48.58 -45.17 37.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.027 1.331 . . . . 64.34 109.997 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.9 mt -57.37 -43.25 83.41 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.747 -1.115 . . . . 64.13 111.949 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -59.13 -46.68 87.73 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.565 0.541 . . . . 71.12 110.16 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -62.6 -43.55 98.53 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.927 -0.578 . . . . 62.42 111.618 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.78 -48.77 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 124.3 1.04 . . . . 73.24 110.96 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.7 mt -62.68 -42.25 95.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 CA-C-N 114.602 -1.181 . . . . 75.44 111.151 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 13' ' ' VAL . 96.5 m -61.02 -50.56 72.87 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.368 0.667 . . . . 70.41 110.252 178.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.2 -42.23 94.64 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.6 0.76 . . . . 71.24 111.019 -177.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.12 99.7 Favored Glycine 0 C--N 1.349 1.254 0 O-C-N 123.618 0.574 . . . . 60.43 112.887 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.35 -43.03 92.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 122.268 0.227 . . . . 54.43 111.242 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 9' ' ' THR . 86.2 t -61.71 -35.32 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.637 0.775 . . . . 73.34 110.526 177.41 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -59.88 -61.02 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.326 1.05 . . . . 70.2 110.439 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.9 -33.12 73.65 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 123.644 0.59 . . . . 74.41 111.187 -175.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -62.21 -60.73 3.16 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.267 1.027 . . . . 72.0 110.825 177.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -78.57 -17.18 56.51 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.134 0.573 . . . . 73.44 112.514 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.5 t -60.95 -16.75 46.25 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.22 1.008 . . . . 61.52 111.49 175.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -58.39 -16.27 14.05 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.61 0.764 . . . . 71.54 112.685 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -62.3 -30.73 71.35 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.613 0.765 . . . . 74.25 111.818 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.5 mmt -67.85 90.38 0.29 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 120.909 0.385 . . . . 63.52 110.264 -175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.75 -49.43 53.13 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 107.806 -1.183 . . . . 73.32 107.806 173.659 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -93.63 -179.51 5.04 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.53 -1.668 . . . . 73.13 109.721 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.592 ' SG ' HG21 ' A' ' 85' ' ' ILE . 34.1 m 53.01 56.24 7.83 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-O 122.199 1.0 . . . . 74.22 110.008 -167.502 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.87 -49.83 41.83 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 113.109 -1.86 . . . . 73.15 110.624 -169.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.1 -39.77 63.16 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.807 -1.088 . . . . 73.53 108.975 -174.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.451 ' NE2' ' H ' ' A' ' 97' ' ' LEU . 69.8 mt-30 -65.12 -27.01 68.44 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.31 0.644 . . . . 63.35 112.031 173.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.3 t -77.24 -35.33 55.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 122.605 0.362 . . . . 53.14 110.656 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -70.07 -33.4 71.86 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 116.412 -0.358 . . . . 61.22 110.416 172.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.488 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -67.94 -58.18 4.97 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.62 0.768 . . . . 74.14 109.822 179.699 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.97 -44.91 83.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.417 1.087 . . . . 73.4 110.359 178.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.58 -49.61 72.19 Favored Glycine 0 C--N 1.346 1.139 0 O-C-N 124.064 0.852 . . . . 41.0 112.87 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -65.9 -38.01 87.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.874 0.47 . . . . 70.32 111.399 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.436 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 83.3 mtt-85 -60.0 -53.59 56.08 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.059 0.543 . . . . 71.14 110.672 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 39' ' ' ILE . 61.9 t -59.5 -50.49 79.72 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.425 0 O-C-N 124.25 0.968 . . . . 51.34 110.846 -177.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.52 -46.49 85.79 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.6 0.563 . . . . 74.22 111.426 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.52 -19.15 74.36 Favored Glycine 0 N--CA 1.468 0.828 0 O-C-N 123.303 0.377 . . . . 53.31 113.367 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -86.64 -48.16 8.55 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.658 0.783 . . . . 64.45 111.663 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 35' ' ' VAL . 14.0 pt -79.54 -34.73 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 119.366 -0.35 . . . . 64.14 111.373 -173.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 44' ' ' MET . 87.5 tttt -57.33 -51.84 78.67 Favored Pre-proline 0 N--CA 1.488 1.449 0 N-CA-C 113.843 1.053 . . . . 73.53 113.843 -174.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.32 -31.78 93.28 Favored 'Trans proline' 0 C--N 1.386 2.542 0 C-N-CA 121.573 1.515 . . . . 51.01 112.042 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.69 -40.99 72.58 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.169 0.588 . . . . 65.31 110.52 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.64 -37.36 83.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.568 0.747 . . . . 60.24 111.016 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -59.0 -55.05 40.21 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.909 0.756 . . . . 74.32 111.173 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 pp -77.42 -33.68 54.88 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.519 -0.764 . . . . 55.52 112.355 -175.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.8 tm0? -72.81 -43.54 62.58 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.311 0.644 . . . . 74.05 110.066 -175.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 122.994 0.518 . . . . 75.44 110.377 175.894 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.6 p . . . . . 0 C--O 1.244 0.778 0 N-CA-C 109.302 -0.629 . . . . 72.41 109.302 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -58.95 -58.67 7.64 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.195 0.598 . . . . 72.43 111.044 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.9 -18.61 60.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.345 0.498 . . . . 64.15 112.345 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.9 -56.19 13.08 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 108.085 -1.079 . . . . 64.44 108.085 175.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 m -62.21 -39.73 93.74 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.071 -0.968 . . . . 72.12 110.824 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 88.5 m -61.44 -44.81 96.47 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.542 0.737 . . . . 73.43 111.36 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.85 86.08 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.142 0.577 . . . . 63.14 110.772 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.83 -27.82 68.53 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.746 0.654 . . . . 61.51 111.037 176.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -75.0 -41.27 59.8 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.144 0.577 . . . . 63.32 110.463 176.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 60' ' ' THR . 87.8 mtt180 -62.2 -40.55 96.44 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.31 0.576 . . . . 73.34 110.161 174.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.6 OUTLIER -65.88 -56.75 10.21 Favored 'General case' 0 C--O 1.216 -0.666 0 CA-C-N 114.422 -1.263 . . . . 75.33 109.277 -177.45 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.0 tmtt? -55.04 -41.28 71.21 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.876 1.27 . . . . 64.1 110.713 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.08 97.78 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.357 0.663 . . . . 60.42 111.296 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.544 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -67.4 -39.48 85.57 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.614 0.766 . . . . 64.22 111.156 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.422 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.4 mm? -67.02 -32.31 73.45 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.539 0.736 . . . . 74.31 111.002 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.8 mt-10 -68.08 -40.64 82.64 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.138 0.575 . . . . 72.25 111.288 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.9 mt-10 -67.92 -38.75 83.3 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.167 0.587 . . . . 72.22 110.11 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.469 ' HA ' ' HE2' ' A' ' 98' ' ' PHE . . . -64.71 -45.85 84.82 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.113 0.565 . . . . 71.35 110.603 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -59.51 -38.97 82.33 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 124.675 1.19 . . . . 63.23 110.561 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.3 -40.36 80.89 Favored Glycine 0 C--N 1.344 0.996 0 CA-C-N 114.894 -1.048 . . . . 75.52 112.472 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 24.0 mm-40 -68.07 -45.23 74.41 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.976 -0.535 . . . . 74.34 111.208 -178.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.603 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.7 OUTLIER -68.02 -26.39 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 CA-C-N 118.525 0.602 . . . . 63.24 111.544 175.703 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.76 -35.06 79.87 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.031 0.443 . . . . 64.3 110.315 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -76.43 -38.39 55.58 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.264 0.626 . . . . 63.43 110.847 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -75.01 -7.41 53.57 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.906 0.882 . . . . 65.43 112.596 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.4 p -57.72 -33.09 68.05 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.18 0.514 . . . . 71.22 110.308 176.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.05 109.81 5.35 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 107.721 -1.214 . . . . 73.33 107.721 164.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -67.57 -30.21 69.77 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 123.563 0.745 . . . . 64.13 111.022 -170.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -72.99 -27.17 61.64 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.153 -0.93 . . . . 60.5 111.67 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -60.85 -40.98 94.96 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 123.794 0.838 . . . . 53.24 110.866 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.592 HG21 ' SG ' ' A' ' 24' ' ' CYS . 16.0 mt -61.06 -55.3 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.165 -0.925 . . . . 74.12 109.252 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.1 -31.07 68.59 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.455 0.702 . . . . 72.55 111.607 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -63.17 -47.62 81.87 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.335 1.054 . . . . 50.44 111.321 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -29.84 43.1 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 120.243 -0.583 . . . . 72.02 110.285 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.44 ' HA ' ' HB3' ' A' ' 92' ' ' SER . 6.8 tp -74.49 -27.0 60.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.682 0.793 . . . . 44.12 111.512 -169.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -71.88 -22.1 61.56 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.947 0.499 . . . . 43.53 110.842 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.44 -35.72 13.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.901 0.88 . . . . 72.44 110.145 174.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.44 ' HB3' ' HA ' ' A' ' 89' ' ' LEU . 32.1 t . . . . . 0 N--CA 1.474 0.748 0 C-N-CA 124.116 0.967 . . . . 62.33 110.974 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 12.4 mm . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 119.274 -0.393 . . . . 73.34 110.103 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.451 ' H ' ' NE2' ' A' ' 27' ' ' GLN . 5.4 tp -49.47 -40.58 37.6 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.389 0.676 . . . . 63.42 111.529 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.603 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 36.1 m-85 -124.38 42.42 3.26 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.681 -1.145 . . . . 74.34 109.993 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -49.87 -66.1 0.45 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.556 0.743 . . . . 73.14 110.461 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.18 -46.78 72.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.088 0.868 . . . . 65.12 111.293 -175.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.8 t -67.58 -55.97 15.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.582 -0.736 . . . . 72.45 111.315 -172.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.534 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 13.8 t30 -63.38 -28.41 69.97 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.999 0.92 . . . . 74.1 111.012 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -61.57 -42.85 99.45 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 110.146 -0.316 . . . . 72.22 110.146 170.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -59.45 -48.44 81.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 123.351 0.407 . . . . 74.11 110.764 173.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.544 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.0 mp -55.52 -41.63 73.39 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.537 0.335 . . . . 73.33 110.465 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.1 t -64.83 -52.92 54.13 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.151 0.98 . . . . 73.23 111.012 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.7 m-20 -65.76 -46.55 78.4 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.672 0.789 . . . . 75.23 111.787 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 85.2 t -66.99 -35.9 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 122.714 0.406 . . . . 65.31 110.545 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 21.4 t-105 -62.74 -41.57 99.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.706 0.402 . . . . 71.53 110.8 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtpt -56.33 -56.16 24.5 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 123.465 0.478 . . . . 75.13 109.746 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.55 -38.97 72.62 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.217 1.007 . . . . 62.41 111.331 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.0 OUTLIER -66.14 -59.62 3.59 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.237 0.961 . . . . 72.4 109.072 -173.729 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -59.06 -33.2 70.5 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.07 0.948 . . . . 70.51 111.195 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.468 ' O ' HG23 ' A' ' 118' ' ' VAL . 70.8 mt -60.55 -63.85 1.16 Allowed 'General case' 0 C--N 1.358 0.946 0 O-C-N 123.752 0.657 . . . . 64.24 111.193 173.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.02 -29.86 71.15 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.34 0.496 . . . . 71.23 112.34 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 88.4 mt -66.78 -45.42 78.5 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.854 0.862 . . . . 73.52 110.603 175.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 114' ' ' LEU . 11.5 pt20 -76.97 -20.29 56.27 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.079 0.152 . . . . 62.42 111.365 -179.288 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 114' ' ' LEU . 54.7 t -71.72 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 123.342 0.657 . . . . 65.04 110.749 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -89.96 -58.48 2.49 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.324 0.583 . . . . 74.42 111.781 -175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -77.8 -12.86 60.01 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.137 -0.938 . . . . 75.15 110.855 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.456 ' O ' ' HD3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER 64.17 18.13 11.08 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.341 1.457 . . . . 72.53 110.787 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 87.9 mtp -64.12 112.66 8.02 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.498 0.719 . . . . 71.52 110.038 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 C--N 1.375 1.929 0 C-N-CA 123.821 3.014 . . . . 71.12 110.753 -176.52 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 113.091 0.775 . . . . 72.3 113.091 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.78 -36.03 79.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.009 0.523 . . . . 52.31 111.577 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -74.75 -36.27 62.59 Favored 'General case' 0 C--O 1.257 1.452 0 C-N-CA 123.301 0.64 . . . . 64.42 110.313 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 37.7 mt-10 -58.16 -62.5 1.78 Allowed 'General case' 0 C--N 1.355 0.818 0 CA-C-N 114.338 -1.301 . . . . 75.41 109.184 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -52.57 -37.06 57.16 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.041 0.838 . . . . 74.12 112.748 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -63.4 -60.63 3.12 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.267 0.354 . . . . 73.41 110.571 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.29 -36.33 83.75 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.456 1.122 . . . . 73.43 110.0 -176.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.67 -63.63 1.02 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 113.493 -1.685 . . . . 61.25 110.32 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 145' ' ' ARG . . . -63.83 -25.23 68.08 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 124.372 1.045 . . . . 60.32 111.564 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 17.4 t70 -60.42 -63.5 1.28 Allowed 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.526 -0.546 . . . . 72.2 109.526 175.318 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.8 -32.0 73.48 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 123.694 0.621 . . . . 63.22 112.116 -177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -71.65 -35.79 70.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.083 0.553 . . . . 74.03 110.644 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 141' ' ' ALA . 3.9 tmt_? -67.0 -39.78 87.19 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.929 0.892 . . . . 65.22 109.216 174.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 12.2 mmt180 -61.34 -48.77 79.81 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.508 0.505 . . . . 75.41 110.0 177.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.32 69.82 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.436 0.695 . . . . 63.31 111.993 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.86 -58.89 3.07 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.569 0.543 . . . . 74.22 110.275 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -75.2 -53.13 9.34 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.324 0.65 . . . . 63.22 111.313 -170.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.8 ttm -86.14 71.22 10.58 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.057 -1.46 . . . . 51.12 107.057 167.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.6 tp . . . . . 0 C--O 1.236 0.368 0 CA-C-N 115.196 -0.911 . . . . 73.04 108.901 -178.725 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 120.478 0.18 . . . . 74.22 111.317 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -60.86 -53.86 52.2 Favored 'General case' 0 N--CA 1.482 1.142 0 O-C-N 123.759 0.662 . . . . 61.31 109.51 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' HG12 ' A' ' 8' ' ' ILE . 52.8 mt -65.84 -36.53 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.587 -1.188 . . . . 74.03 111.29 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -58.95 -48.17 82.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.542 -0.91 . . . . 72.41 108.542 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -70.21 -42.29 72.51 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-N 115.923 -0.58 . . . . 72.01 111.961 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.4 mt -56.62 -46.26 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.265 0.555 . . . . 62.24 110.892 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 4' ' ' LEU . 35.3 mm -72.72 -42.32 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.397 -0.819 . . . . 64.35 111.023 -176.114 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' HG23 ' A' ' 13' ' ' VAL . 86.6 m -64.34 -53.99 39.96 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.351 0.261 . . . . 73.11 110.453 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.9 mt -57.02 -51.5 69.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.925 0.89 . . . . 53.13 111.263 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.426 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -64.59 -32.04 82.88 Favored Glycine 0 C--N 1.344 1.021 0 O-C-N 123.907 0.755 . . . . 51.24 113.714 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.5 -44.99 56.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 122.689 -0.301 . . . . 74.34 110.632 176.142 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 75.3 t -59.31 -35.89 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.309 0.643 . . . . 75.22 109.893 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.573 HG21 HG21 ' A' ' 35' ' ' VAL . 29.6 mt -57.5 -54.36 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.464 1.105 . . . . 72.12 109.882 171.726 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -53.85 -34.93 60.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.941 0.896 . . . . 64.34 111.463 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -77.45 -47.22 20.27 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 112.266 0.469 . . . . 73.11 112.266 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.3 ptp180 -83.76 -17.24 41.83 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 112.851 0.686 . . . . 72.31 112.851 -173.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.08 -24.87 67.58 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.035 0.534 . . . . 53.15 111.671 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.8 -7.16 49.36 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.146 0.424 . . . . 74.54 112.146 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -61.14 -21.6 63.9 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.485 0.714 . . . . 74.01 111.612 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 21.6 mmt -67.78 88.57 0.25 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 124.013 0.821 . . . . 74.51 109.891 176.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.478 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 0.2 OUTLIER -69.93 -30.73 68.19 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.462 0.649 . . . . 71.24 109.901 170.343 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' MET . 53.0 m-85 -106.44 172.87 6.58 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.256 1.022 . . . . 74.52 108.472 167.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.548 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 66.4 m 58.95 73.91 0.46 Allowed 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.456 0.646 . . . . 75.34 110.705 -170.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.99 -59.49 2.88 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.715 1.206 . . . . 73.3 110.665 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 45.8 mmtm -68.33 -29.07 67.73 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 114.439 -1.255 . . . . 71.33 110.323 -175.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.433 ' HG2' ' CB ' ' A' ' 97' ' ' LEU . 0.3 OUTLIER -71.88 -40.18 69.11 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 123.611 0.569 . . . . 64.14 111.562 177.275 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.53 -41.32 97.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.315 0.578 . . . . 75.35 109.831 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -77.27 -24.14 51.08 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.093 -0.958 . . . . 63.2 111.487 176.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 137' ' ' ASP . 0.1 OUTLIER -70.13 -57.82 4.51 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 122.077 0.941 . . . . 74.11 109.803 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.94 -44.97 91.21 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.115 -1.857 . . . . 75.11 108.86 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.58 -53.2 48.0 Favored Glycine 0 C--N 1.353 1.477 0 O-C-N 123.877 0.736 . . . . 63.34 113.625 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -63.29 -45.44 91.43 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.219 0.607 . . . . 72.4 111.342 -175.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.616 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.6 mtt-85 -58.35 -58.03 10.31 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 123.763 0.664 . . . . 73.13 110.913 178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 14' ' ' ILE . 79.2 t -56.94 -40.21 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.564 0.54 . . . . 75.52 111.358 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.411 HD23 HD11 ' A' ' 39' ' ' ILE . 71.7 mt -61.32 -48.39 81.56 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.589 0.356 . . . . 74.42 111.765 174.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.14 -21.44 61.68 Favored Glycine 0 N--CA 1.47 0.956 0 CA-C-N 116.613 -0.267 . . . . 74.23 113.202 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 61.7 mt -87.02 -52.19 5.58 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.383 0.673 . . . . 73.25 112.442 175.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 24.1 pt -74.23 -42.74 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 118.63 -0.7 . . . . 62.11 111.766 -169.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' MET . 53.2 mtmt -56.43 -51.49 80.59 Favored Pre-proline 0 N--CA 1.489 1.483 0 CA-C-O 118.071 -0.966 . . . . 70.51 112.786 -173.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 40' ' ' LYS . 77.8 Cg_exo -51.89 -45.64 37.25 Favored 'Trans proline' 0 C--N 1.4 3.249 0 C-N-CA 122.295 1.997 . . . . 75.02 112.334 174.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.464 HD13 HD21 ' A' ' 45' ' ' LEU . 4.5 mm? -66.39 -33.03 74.79 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.017 -0.992 . . . . 52.42 111.563 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 49.7 mt-10 -70.55 -35.17 72.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.403 0.681 . . . . 63.22 110.401 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -67.93 -47.13 69.57 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.477 0.485 . . . . 65.22 110.498 -178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.464 HD21 HD13 ' A' ' 42' ' ' LEU . 4.2 pp -75.16 -30.87 60.87 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.744 0.418 . . . . 62.4 111.739 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -70.87 -35.43 72.37 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.325 0.65 . . . . 72.52 110.703 175.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 . . . . . 0 N--CA 1.483 1.191 0 C-N-CA 123.177 0.591 . . . . 61.31 110.715 -178.741 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 110.119 -0.326 . . . . 74.33 110.119 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.8 -57.05 13.34 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.078 0.951 . . . . 72.34 111.55 -174.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -70.81 -23.64 62.4 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.816 0.446 . . . . 63.45 111.787 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -48.29 73.27 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.273 -1.01 . . . . 71.23 108.273 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 43.3 m -68.41 -41.73 80.0 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.947 -1.024 . . . . 74.54 111.066 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 62.4 m -61.27 -40.53 94.44 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.307 0.643 . . . . 53.34 110.704 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.556 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -64.4 -44.69 90.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.98 0.512 . . . . 74.23 110.454 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.9 mmt -64.0 -25.86 68.32 Favored 'General case' 0 CA--C 1.558 1.278 0 O-C-N 123.92 0.763 . . . . 73.12 111.844 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -77.14 -44.75 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.843 0.857 . . . . 71.23 110.772 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.5 mtp85 -61.12 -40.6 94.37 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.042 0.937 . . . . 75.12 109.393 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -67.92 -51.61 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 114.099 -1.409 . . . . 75.3 110.002 -177.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 14.5 tmtt? -54.97 -47.95 73.88 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.933 1.293 . . . . 75.04 110.999 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -65.25 -40.7 94.35 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.687 0.617 . . . . 60.14 111.407 -178.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.54 -41.57 98.44 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.21 0.604 . . . . 51.14 111.248 177.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 14' ' ' ILE . 11.0 mp -65.11 -32.17 73.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.335 0.654 . . . . 73.54 111.675 174.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 50.2 mt-10 -64.74 -40.91 96.12 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.685 0.394 . . . . 64.31 110.974 174.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' HB2' HG13 ' A' ' 101' ' ' VAL . 47.8 mt-10 -62.54 -49.69 74.29 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.629 0.581 . . . . 74.31 110.031 177.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.457 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.22 -44.02 92.3 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 123.96 0.787 . . . . 63.03 111.103 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -59.92 -44.69 94.16 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.152 1.381 . . . . 74.14 110.77 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.67 -39.43 93.73 Favored Glycine 0 C--N 1.343 0.952 0 CA-C-N 114.996 -1.002 . . . . 55.5 112.32 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -59.97 -57.89 10.9 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.154 0.477 . . . . 54.45 110.302 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.457 HG12 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -63.55 -23.19 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 112.659 0.614 . . . . 75.24 112.659 177.453 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.406 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 33.4 tt0 -65.16 -44.64 87.9 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.584 0.354 . . . . 73.32 110.921 173.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -87.82 -19.11 27.91 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.513 0.325 . . . . 64.24 111.288 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 11.5 m-30 -82.0 0.84 38.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.43 0.692 . . . . 75.11 111.578 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 74.1 p -57.47 -24.9 58.46 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.316 0.646 . . . . 72.15 110.668 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -85.35 95.59 9.28 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 108.224 -1.028 . . . . 71.54 108.224 168.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.543 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -73.13 -31.63 64.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.715 0.806 . . . . 53.54 112.064 -169.434 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.8 p -74.11 -32.89 63.39 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.978 0.511 . . . . 72.33 110.803 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -66.43 -32.91 74.58 Favored 'General case' 0 C--O 1.249 1.06 0 C-N-CA 123.756 0.822 . . . . 70.42 109.964 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 36.9 mt -55.88 -53.05 42.38 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 109.017 -0.734 . . . . 73.51 109.017 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 148' ' ' PHE . 42.8 t -57.05 -39.35 74.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.909 0.884 . . . . 62.14 111.747 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -58.68 -51.24 70.78 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 114.994 -1.003 . . . . 64.11 110.891 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.41 -23.14 50.67 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.677 0.391 . . . . 63.34 110.831 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -72.21 -47.18 52.47 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.974 0.91 . . . . 74.43 110.506 -172.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -63.12 -29.04 70.48 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.838 -0.619 . . . . 63.33 110.415 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.41 61.03 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.59 0.756 . . . . 71.02 111.029 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 123.757 0.823 . . . . 73.31 109.899 179.591 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 2.5 mp . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 107.45 -1.315 . . . . 72.41 107.45 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.433 ' CB ' ' HG2' ' A' ' 27' ' ' GLN . 13.5 tp -69.57 -32.85 71.86 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.44 0.638 . . . . 63.22 111.157 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -109.21 16.76 22.22 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 115.033 -0.985 . . . . 74.2 111.669 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 85.6 tttt -42.54 -57.35 2.7 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.96 1.467 . . . . 74.33 114.96 -163.493 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.67 -48.7 65.89 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.906 0.882 . . . . 74.33 111.255 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.2 t -61.72 -52.72 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.948 0.899 . . . . 73.44 110.978 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -68.35 -26.32 65.53 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.873 1.269 . . . . 72.35 110.712 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.438 ' NH1' ' HB2' ' A' ' 107' ' ' ASP . 15.3 tpt180 -61.35 -43.59 98.61 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.446 0.699 . . . . 71.05 109.845 168.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -60.26 -49.77 76.29 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 119.046 -0.502 . . . . 61.11 111.577 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.497 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.8 mp -55.33 -37.84 67.96 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-N 118.607 0.639 . . . . 62.22 111.261 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.616 ' HB2' HH12 ' A' ' 34' ' ' ARG . 32.9 t -67.13 -53.03 34.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.804 0.842 . . . . 63.22 111.12 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.576 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 5.7 t70 -78.43 -29.23 46.95 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.745 -0.661 . . . . 74.21 111.146 -170.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 70.3 t -79.46 -27.38 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.947 0.499 . . . . 73.51 110.165 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -65.45 -39.73 92.37 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 118.717 0.69 . . . . 73.51 110.21 168.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.576 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 49.2 mtpt -54.92 -59.05 5.27 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 123.494 0.496 . . . . 73.41 109.793 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 50.0 mt-10 -53.45 -47.96 69.26 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.523 1.14 . . . . 51.13 110.568 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 2.6 tp -57.91 -59.66 4.9 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.382 1.073 . . . . 63.24 109.592 -173.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.3 t -55.08 -41.41 71.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.675 1.19 . . . . 64.05 112.103 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.41 -47.21 67.87 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.074 -0.512 . . . . 73.43 111.996 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.556 HD21 ' HB2' ' A' ' 61' ' ' ALA . 4.2 pp -78.4 -19.29 53.6 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.818 -0.551 . . . . 72.02 111.43 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.468 ' HG ' ' HE2' ' A' ' 122' ' ' MET . 2.0 mp -63.46 -53.36 53.31 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.923 -0.769 . . . . 65.11 108.923 169.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -72.18 -27.69 62.72 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.651 0.38 . . . . 73.05 112.024 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.93 -63.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.852 0.461 . . . . 62.31 110.956 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -85.36 -58.23 2.76 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.486 0.715 . . . . 74.53 111.484 -165.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -88.55 -2.97 58.89 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.284 0.634 . . . . 75.25 110.318 -176.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 54.85 35.85 25.21 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.73 1.612 . . . . 35.12 112.363 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.468 ' HE2' ' HG ' ' A' ' 116' ' ' LEU . 27.7 mtm -95.66 129.3 34.97 Favored Pre-proline 0 N--CA 1.477 0.917 0 O-C-N 121.669 -0.644 . . . . 63.12 110.336 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo . . . . . 0 C--N 1.37 1.698 0 C-N-CA 123.523 2.815 . . . . 53.13 112.11 -175.59 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 22.0 m0 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 113.753 1.02 . . . . 73.31 113.753 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.77 -25.26 48.94 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 120.796 0.331 . . . . 71.55 111.557 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -89.71 -50.83 5.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.738 0.815 . . . . 62.45 111.126 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 133' ' ' TRP . 11.5 pt-20 -57.05 -42.33 80.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.528 0.731 . . . . 42.44 111.754 -174.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.0 OUTLIER -60.09 -51.26 70.36 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.152 0.581 . . . . 63.32 112.012 -177.355 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -69.42 -39.27 77.97 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.219 0.324 . . . . 54.34 111.515 -175.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -66.99 -57.91 5.97 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.642 0.734 . . . . 50.51 111.3 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.614 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 1.2 m-20 -55.53 -51.92 65.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.194 -1.366 . . . . 73.4 111.119 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -66.93 -27.26 67.34 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.286 0.476 . . . . 73.31 112.286 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -58.83 -58.45 8.58 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.102 -0.703 . . . . 74.03 109.102 172.586 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.58 -25.15 65.63 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.802 -1.544 . . . . 62.32 111.609 -177.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.431 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.2 t0 -84.51 -42.26 15.71 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.634 0.774 . . . . 75.43 111.898 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.751 0.82 . . . . 74.01 109.13 170.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -61.79 -43.96 97.82 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.409 -1.269 . . . . 73.5 110.773 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.1 -18.08 60.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.331 0.653 . . . . 71.04 112.325 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.548 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.5 OUTLIER -78.42 -60.81 2.22 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.967 -0.753 . . . . 73.22 108.967 176.267 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -73.73 -51.27 17.08 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.803 -1.09 . . . . 70.43 110.866 -171.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 28.4 mmt -101.82 51.74 0.83 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.065 -0.716 . . . . 73.13 109.065 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.475 0.796 0 CA-C-N 115.152 -0.931 . . . . 73.32 109.443 -176.162 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 120.547 0.213 . . . . 62.32 111.247 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -67.76 -38.25 83.2 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.863 -0.608 . . . . 73.22 109.694 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' A' ' 42' ' ' LEU . 31.6 tp -69.23 -36.52 77.28 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.134 -0.939 . . . . 62.41 110.734 176.77 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 46' ' ' GLN . 3.2 tmtp? -63.6 -42.44 98.23 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 108.612 -0.885 . . . . 73.42 108.612 177.594 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -58.41 -44.74 89.14 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.291 0.994 . . . . 70.31 110.765 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.401 HD11 ' HA ' ' A' ' 62' ' ' MET . 82.1 mt -54.31 -50.94 52.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 124.191 0.996 . . . . 51.1 111.077 174.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 4' ' ' LEU . 24.9 mm -63.27 -43.71 98.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.989 0.916 . . . . 71.35 111.02 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.8 m -64.15 -48.55 75.57 Favored 'General case' 0 C--N 1.348 0.511 0 O-C-N 123.966 0.791 . . . . 74.41 110.325 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.0 -45.87 86.15 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 124.025 0.828 . . . . 73.43 110.72 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.568 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -59.97 -46.05 94.82 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 124.346 1.029 . . . . 24.3 113.027 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -63.38 -49.63 73.07 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 122.56 0.344 . . . . 64.33 110.627 178.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 84.3 t -60.84 -33.15 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.759 0.824 . . . . 73.51 110.932 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.462 HG21 HG21 ' A' ' 35' ' ' VAL . 17.3 mt -57.82 -54.68 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.179 0.992 . . . . 72.54 109.007 174.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -62.2 -31.28 71.79 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.013 0.82 . . . . 72.01 111.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.86 -59.95 3.08 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.719 0.407 . . . . 72.11 111.172 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 16.4 ptp180 -73.34 -16.56 61.36 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 112.621 0.6 . . . . 70.34 112.621 -175.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.41 ' SG ' HD23 ' A' ' 31' ' ' LEU . 46.1 t -66.72 -22.83 66.05 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.305 0.642 . . . . 43.43 110.864 173.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -76.34 2.91 12.14 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 60.31 111.836 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -86.54 -1.22 57.45 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.536 0.734 . . . . 75.04 111.978 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 15.0 mmt -80.81 95.9 6.82 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.912 0.387 . . . . 74.44 110.987 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HB3' ' HG2' ' A' ' 82' ' ' ARG . 12.1 tptt -67.97 -41.1 82.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.546 1.138 . . . . 51.3 110.014 170.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -97.17 -178.66 4.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 114.979 -1.01 . . . . 72.4 109.225 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.9 p 46.68 62.35 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.768 1.227 . . . . 71.13 111.608 175.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 22' ' ' LYS . 32.8 mmtp -73.39 -38.95 65.46 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.58 -1.191 . . . . 65.21 111.742 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 140' ' ' ASP . 58.8 tptt -63.26 -47.67 81.42 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.832 -1.174 . . . . 74.11 107.832 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.4 ' HG2' HD12 ' A' ' 97' ' ' LEU . 3.0 tp-100 -46.82 -54.37 10.01 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.848 1.659 . . . . 72.43 111.129 175.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 20.4 t -62.17 -50.78 70.47 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.725 1.21 . . . . 63.4 112.88 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -73.6 -37.75 65.33 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.207 0.603 . . . . 74.12 111.8 -171.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -81.15 -28.13 35.19 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.304 0.377 . . . . 74.41 110.066 -178.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.41 HD23 ' SG ' ' A' ' 18' ' ' CYS . 69.2 tp -62.26 -51.13 68.98 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 108.262 -1.014 . . . . 65.22 108.262 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.1 -36.2 91.98 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 124.152 0.908 . . . . 60.51 113.089 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -64.49 -53.92 40.61 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 124.031 0.933 . . . . 64.43 110.348 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -46.9 -60.69 2.27 Favored 'General case' 0 C--N 1.367 1.362 0 O-C-N 124.992 1.433 . . . . 54.23 109.282 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.462 HG21 HG21 ' A' ' 14' ' ' ILE . 48.2 t -57.64 -48.1 84.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 125.182 1.393 . . . . 74.53 112.596 -171.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.5 mt -65.48 -50.13 66.46 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 118.442 0.565 . . . . 61.33 110.726 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.12 -19.66 66.25 Favored Glycine 0 C--N 1.351 1.405 0 O-C-N 123.78 0.675 . . . . 60.22 112.752 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.554 HD11 ' HZ ' ' A' ' 65' ' ' PHE . 19.2 tp -84.46 -50.32 7.86 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.571 1.148 . . . . 73.43 111.974 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.568 HG21 ' HA3' ' A' ' 11' ' ' GLY . 10.1 pt -79.21 -30.95 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.1 0.56 . . . . 63.41 111.221 -171.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 15.4 tppt? -58.68 -53.98 60.85 Favored Pre-proline 0 CA--C 1.567 1.608 0 CA-C-O 118.031 -0.985 . . . . 71.41 113.033 -174.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -61.17 -31.09 89.8 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 121.613 1.542 . . . . 75.03 112.303 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 4' ' ' LEU . 4.3 mm? -78.03 -36.55 48.45 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.448 0.699 . . . . 74.03 111.24 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 12.0 pt-20 -77.79 -20.34 53.47 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 119.192 -0.432 . . . . 65.51 111.574 -177.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.0 mmt -60.53 -56.31 22.87 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.45 0.469 . . . . 64.02 110.681 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 pp -72.64 -30.83 64.64 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.1 0.56 . . . . 75.21 111.437 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.525 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.0 OUTLIER -64.03 -44.61 92.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.507 0.723 . . . . 73.24 111.051 175.611 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 N--CA 1.485 1.32 0 C-N-CA 123.864 0.866 . . . . 71.24 111.121 -178.452 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.1 m . . . . . 0 CA--C 1.554 1.131 0 N-CA-C 111.79 0.293 . . . . 71.3 111.79 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -62.67 -37.91 88.26 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.822 0.449 . . . . 72.24 111.011 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -67.49 -31.6 71.85 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.334 0.654 . . . . 72.54 111.031 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.09 -50.74 63.02 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.105 0.562 . . . . 75.42 109.522 174.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 m -58.39 -48.68 79.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.174 0.99 . . . . 72.11 111.228 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -61.76 -43.97 97.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.057 0.943 . . . . 75.45 110.671 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.54 98.82 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.857 0.723 . . . . 73.25 110.928 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.406 ' SD ' ' HB2' ' A' ' 4' ' ' LEU . 31.2 mmt -64.38 -43.03 95.75 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.507 0.723 . . . . 62.41 110.694 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -66.6 -39.57 88.46 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 124.004 0.922 . . . . 72.15 111.3 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.423 ' HE ' HG22 ' A' ' 108' ' ' VAL . 49.7 ttt85 -72.34 -38.07 68.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.583 1.553 . . . . 75.31 111.002 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.554 ' HZ ' HD11 ' A' ' 38' ' ' LEU . 2.4 t80 -73.87 -43.77 57.52 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.896 -1.047 . . . . 63.41 109.515 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.0 ttpp -55.97 -47.42 77.69 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 114.288 -1.323 . . . . 61.35 109.925 172.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.87 92.2 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.826 0.85 . . . . 74.41 111.643 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.584 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.02 -42.3 98.2 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 115.421 -0.809 . . . . 74.43 110.978 175.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.02 -26.7 62.32 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.378 0.671 . . . . 72.43 111.852 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 97.8 mt-10 -65.58 -43.81 88.6 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 108.664 -0.865 . . . . 75.44 108.664 175.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 50.8 mt-10 -61.03 -52.69 63.92 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.741 -1.118 . . . . 70.34 110.365 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.91 -45.99 82.26 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 124.085 0.866 . . . . 71.55 111.454 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.08 -36.04 80.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.513 1.125 . . . . 71.5 110.28 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 77' ' ' GLU . . . -69.38 -36.02 77.22 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.289 -0.869 . . . . 72.02 112.881 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 14.4 mm-40 -65.33 -55.41 18.38 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.528 0.664 . . . . 73.03 110.041 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.521 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.2 pt -64.2 -27.06 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 112.581 0.586 . . . . 65.54 112.581 176.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.443 ' HB3' ' O ' ' A' ' 74' ' ' GLY . 11.3 tt0 -56.39 -49.13 75.36 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.957 0.503 . . . . 72.54 110.669 169.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -78.03 -28.89 49.15 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.188 0.595 . . . . 60.24 110.968 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.443 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 19.2 m-30 -81.05 -5.8 58.05 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.767 0.827 . . . . 72.24 112.323 -178.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 97.1 p -60.14 -33.06 71.64 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.413 -0.588 . . . . 63.13 109.413 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -82.66 109.13 16.57 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.678 -1.23 . . . . 63.34 107.678 165.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.647 ' HG2' ' HB3' ' A' ' 22' ' ' LYS . 3.4 mpt_? -74.53 -25.65 59.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.25 0.62 . . . . 61.35 111.645 -172.121 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.3 m -62.84 -37.3 86.25 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.839 0.856 . . . . 53.32 110.592 174.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -60.35 -39.22 86.37 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 124.371 1.068 . . . . 75.2 111.072 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 26.0 mt -59.64 -53.96 41.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.201 0 O-C-N 123.829 0.706 . . . . 65.3 109.653 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 16.9 t -62.07 -38.05 87.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.13 0.572 . . . . 72.21 111.717 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.3 tpp180 -59.86 -47.88 83.97 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.389 1.076 . . . . 75.52 110.96 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.81 -22.39 40.07 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 116.15 -0.477 . . . . 75.01 110.555 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 17.3 tp -71.81 -41.24 68.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.776 0.831 . . . . 62.12 110.717 -173.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -71.22 -21.37 62.14 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.896 -0.593 . . . . 74.02 110.565 176.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.75 10.94 32.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.156 0.983 . . . . 55.52 111.058 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 C--N 1.357 0.916 0 C-N-CA 123.14 0.576 . . . . 74.11 110.718 -174.879 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.803 HG13 ' HB2' ' A' ' 141' ' ' ALA . 1.4 mp . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.15 -1.055 . . . . 65.31 108.15 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.4 HD12 ' HG2' ' A' ' 27' ' ' GLN . 26.3 mt -76.93 -46.84 22.82 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.909 0.862 . . . . 74.01 108.792 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.521 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 13.8 m-85 -98.51 34.6 1.98 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.152 -1.386 . . . . 73.52 110.455 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.663 ' HG3' HD13 ' A' ' 96' ' ' ILE . 22.1 ttpt -52.58 -65.2 0.6 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.735 0.698 . . . . 74.55 112.058 -172.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -65.92 -47.85 73.39 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.82 0.7 . . . . 74.54 110.558 -173.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 84.4 t -60.7 -57.82 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 124.287 0.992 . . . . 72.0 111.951 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -72.32 -24.16 61.27 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.811 0.844 . . . . 75.15 111.273 -174.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -66.94 -35.9 81.03 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.95 -0.389 . . . . 74.14 109.95 168.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 108' ' ' VAL . 60.1 mtpt -69.67 -37.81 76.83 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 119.113 -0.47 . . . . 63.12 110.64 172.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.584 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.9 mp -55.61 -45.2 77.54 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.553 -0.536 . . . . 74.2 109.553 171.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -63.11 -53.86 46.9 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 124.127 0.892 . . . . 42.14 110.885 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -60.7 -52.92 63.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.549 1.14 . . . . 70.43 111.508 -174.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.423 HG22 ' HE ' ' A' ' 64' ' ' ARG . 59.1 t -63.02 -42.97 98.69 Favored 'Isoleucine or valine' 0 C--N 1.344 0.346 0 O-C-N 124.07 0.856 . . . . 73.12 110.345 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -61.76 -35.24 77.55 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.374 0.422 . . . . 73.33 111.403 177.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 57.6 mtpt -61.24 -55.35 32.99 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.712 -0.477 . . . . 74.14 109.712 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.1 -41.48 75.31 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.007 0.923 . . . . 73.53 111.05 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 3.7 tt -75.0 -47.78 27.42 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 114.115 -1.402 . . . . 72.04 110.45 -170.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.3 p -65.22 -33.41 75.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.222 0.609 . . . . 63.43 110.541 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.44 ' O ' HG23 ' A' ' 118' ' ' VAL . 80.0 mt -60.21 -57.13 14.12 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.892 0.745 . . . . 71.21 110.453 172.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.12 -23.77 67.23 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 111.801 0.297 . . . . 71.4 111.801 -178.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.7 mt -70.28 -45.58 66.06 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.876 -0.416 . . . . 72.34 109.876 171.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.424 ' O ' ' HA ' ' A' ' 121' ' ' ARG . 30.0 tt0 -77.13 -19.71 56.54 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.611 0.764 . . . . 61.11 111.185 -174.312 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 114' ' ' LEU . 64.1 t -91.36 -56.42 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 122.947 0.499 . . . . 74.34 110.288 177.17 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -73.51 -59.13 2.86 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.082 0.468 . . . . 71.44 110.736 -175.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -84.93 -16.43 41.1 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.588 -0.733 . . . . 72.33 110.767 -175.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 60.4 mtm-85 57.14 44.16 22.86 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.443 1.097 . . . . 54.24 110.013 -175.343 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.464 ' SD ' HD13 ' A' ' 116' ' ' LEU . 44.7 ttm -70.86 127.42 91.79 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 114.637 -1.165 . . . . 70.23 111.081 -174.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 6.3 Cg_exo . . . . . 0 C--N 1.371 1.727 0 C-N-CA 122.729 2.286 . . . . 64.33 109.846 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 112.292 0.479 . . . . 74.32 112.292 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -84.0 -34.08 24.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.0 0.52 . . . . 61.5 111.492 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -80.0 -33.05 39.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.897 0.879 . . . . 72.41 111.584 -173.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -59.88 -37.54 79.65 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 123.492 0.495 . . . . 63.51 109.825 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.87 -37.71 83.06 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.628 1.171 . . . . 75.35 111.573 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -68.84 -50.31 51.1 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.265 0.353 . . . . 73.03 111.287 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.1 -42.02 93.78 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 123.806 0.691 . . . . 74.02 110.481 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.468 ' HA ' ' HG2' ' A' ' 26' ' ' LYS . 1.4 t70 -60.7 -54.1 49.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.052 1.741 . . . . 63.02 110.918 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.803 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -53.98 -53.02 58.61 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.13 -1.396 . . . . 51.04 112.067 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.57 -45.33 85.32 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.1 -1.409 . . . . 73.32 111.114 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.22 -52.47 58.63 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 124.728 1.268 . . . . 53.21 111.159 -172.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.51 -38.01 68.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 124.022 0.826 . . . . 63.45 111.725 -174.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 149' ' ' GLN . 0.0 OUTLIER -57.41 -50.23 73.68 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.498 0.499 . . . . 62.11 109.891 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ARG . . . . . 0.415 ' N ' ' HD3' ' A' ' 145' ' ' ARG . 5.7 tmm_? -71.47 -31.19 66.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.501 0.72 . . . . 63.45 110.035 -176.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.2 -19.83 53.09 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.189 0.596 . . . . 52.43 111.675 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -80.42 -50.94 9.43 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.772 -0.825 . . . . 75.15 108.772 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 149' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 145' ' ' ARG . 25.1 mm-40 -60.82 -60.19 4.19 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.902 0.752 . . . . 63.21 109.581 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 5.9 mmt -99.8 66.67 1.41 Allowed 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.361 1.064 . . . . 52.33 109.071 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 C--N 1.351 0.672 0 CA-C-O 121.986 0.898 . . . . 53.54 109.864 179.67 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.493 0.187 . . . . 64.31 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -68.88 -36.75 78.47 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 116.023 -0.535 . . . . 71.35 111.265 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.453 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.1 mm? -62.97 -47.26 83.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.544 0.337 . . . . 62.41 110.519 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -57.42 -43.27 83.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.309 0.644 . . . . 72.41 109.829 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -61.57 -63.98 1.09 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-O 118.385 -0.816 . . . . 72.32 111.085 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.0 mt -47.98 -45.59 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.094 0.958 . . . . 71.31 112.917 -174.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -70.92 -48.55 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 115.647 -0.706 . . . . 44.15 110.987 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.1 m -61.62 -48.55 80.37 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 123.179 0.299 . . . . 74.1 110.305 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -57.19 -45.02 84.11 Favored 'General case' 0 C--O 1.208 -1.118 0 C-N-CA 124.648 1.179 . . . . 55.32 110.949 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.431 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -63.15 -42.29 99.49 Favored Glycine 0 C--N 1.347 1.167 0 O-C-N 124.244 0.965 . . . . 72.43 113.075 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -65.13 -43.24 92.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.198 0.599 . . . . 62.13 111.753 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -76.03 -25.29 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.619 0.767 . . . . 62.03 110.541 -178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.46 -51.77 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.841 0.856 . . . . 74.11 108.877 171.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -61.32 -36.54 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 124.12 0.888 . . . . 74.3 110.335 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -56.02 19.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.428 1.091 . . . . 74.21 110.56 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.491 ' HD2' HG13 ' A' ' 76' ' ' ILE . 5.2 ptp180 -75.84 -16.28 60.1 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.679 -0.691 . . . . 72.13 111.723 -178.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 48.2 t -72.15 -21.53 61.44 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.29 0.636 . . . . 70.24 110.54 172.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -81.18 0.01 38.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.502 0.721 . . . . 74.45 111.979 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.5 -29.73 70.41 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.457 -0.572 . . . . 55.41 109.457 165.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.1 mmt -71.15 89.57 0.85 Allowed 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.066 -0.516 . . . . 72.12 109.623 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -75.25 -27.21 59.37 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 108.496 -0.927 . . . . 72.32 108.496 170.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -93.33 172.32 8.36 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.597 1.159 . . . . 60.31 108.319 163.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.461 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 28.5 m 51.93 48.69 22.27 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.275 0.56 . . . . 53.25 110.878 -176.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 94.5 mttt -63.78 -41.04 98.02 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.047 -0.978 . . . . 72.13 111.035 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 0.5 OUTLIER -75.97 -22.92 55.4 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.958 -0.565 . . . . 54.33 109.735 -176.84 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.608 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 11.7 mm-40 -69.47 -40.56 77.02 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 123.005 0.522 . . . . 75.13 110.665 168.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.572 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 41.9 t -59.25 -42.63 91.55 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.359 0.663 . . . . 73.21 110.001 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 11.5 mpt_? -77.12 -30.31 55.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.429 -0.805 . . . . 74.44 111.859 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 ttp85 -71.39 -60.03 2.45 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.369 0.668 . . . . 63.02 110.453 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 18' ' ' CYS . 46.9 tp -56.61 -43.8 80.51 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.714 -1.13 . . . . 73.22 109.978 174.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.09 -49.12 74.27 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.103 0.877 . . . . 72.51 113.192 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -60.95 -47.76 84.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.811 0.845 . . . . 73.43 110.903 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 31.5 mtt180 -60.59 -60.33 3.98 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.093 0.871 . . . . 72.21 111.286 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.91 -45.07 75.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 124.306 1.004 . . . . 63.44 111.528 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.49 -44.16 97.57 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.623 0.577 . . . . 74.51 110.752 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.09 -25.82 71.14 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 123.517 0.511 . . . . 62.13 113.521 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 40.8 mt -79.96 -49.8 11.34 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.385 0.674 . . . . 74.13 110.983 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 10.5 pt -74.43 -33.69 33.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 CA-C-O 118.372 -0.823 . . . . 73.44 111.224 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -44.53 -58.61 4.95 Favored Pre-proline 0 N--CA 1.503 2.2 0 C-N-CA 124.914 1.286 . . . . 65.44 113.87 -170.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.46 ' HG2' HD22 ' A' ' 42' ' ' LEU . 35.0 Cg_endo -62.72 -42.05 27.69 Favored 'Trans proline' 0 C--N 1.401 3.338 0 C-N-CA 121.383 1.389 . . . . 75.34 110.692 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.6 mm? -70.11 -20.2 63.2 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.571 0.748 . . . . 63.4 111.499 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' HG23 ' A' ' 8' ' ' ILE . 63.7 mt-10 -73.62 -45.31 53.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.796 0.839 . . . . 73.02 109.561 175.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.4 -33.18 74.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.659 -0.7 . . . . 70.12 110.802 174.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.09 -21.06 36.97 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.007 0.923 . . . . 32.33 111.847 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -75.27 -38.11 60.6 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.765 0.426 . . . . 55.15 110.042 173.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 N--CA 1.477 0.893 0 C-N-CA 123.391 0.677 . . . . 71.04 110.407 176.332 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 110.389 -0.226 . . . . 73.54 110.389 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.47 -32.14 73.32 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 110.168 -0.308 . . . . 72.11 110.168 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -71.77 -30.87 66.03 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.487 0.315 . . . . 74.31 111.132 175.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.1 -51.21 57.08 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 107.883 -1.155 . . . . 73.44 107.883 176.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.1 m -58.06 -47.59 82.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.454 1.102 . . . . 75.14 111.198 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.4 m -65.88 -40.9 92.04 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.768 0.827 . . . . 70.33 111.14 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.48 -41.68 96.34 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.803 0.441 . . . . 70.01 110.283 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.51 -26.67 64.65 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.105 0.562 . . . . 55.22 111.261 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.51 ' HA ' ' HE2' ' A' ' 66' ' ' LYS . 84.8 m-20 -76.44 -38.28 55.73 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.466 0.706 . . . . 73.34 110.632 176.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.19 -39.51 78.64 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.737 0.815 . . . . 74.11 109.811 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -67.62 -49.0 65.17 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.286 1.034 . . . . 72.24 109.014 -177.916 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 63' ' ' ASN . 37.1 ttpt -55.59 -46.1 77.3 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.054 1.342 . . . . 74.13 111.754 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -70.56 -32.22 69.55 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.463 0.705 . . . . 75.11 111.454 -177.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -71.02 -32.43 69.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.356 0.662 . . . . 72.12 109.885 175.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 95.1 mt -73.11 -27.59 61.78 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.595 -0.73 . . . . 60.14 110.502 173.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -66.55 -41.78 88.16 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.777 0.431 . . . . 74.03 110.637 171.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.43 ' HB2' HG13 ' A' ' 101' ' ' VAL . 16.5 mm-40 -60.58 -49.29 78.13 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.63 0.581 . . . . 64.13 109.977 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.506 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.18 -46.8 88.47 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.9 0.75 . . . . 73.42 111.264 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.19 -47.53 78.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.5 1.12 . . . . 74.23 110.599 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.73 -37.73 94.72 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.083 -0.962 . . . . 63.2 112.878 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -61.46 -53.07 61.3 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.0 0.52 . . . . 71.42 110.978 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.568 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -69.12 -20.31 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 N-CA-C 112.239 0.459 . . . . 72.04 112.239 179.305 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -67.26 -41.03 86.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.262 0.553 . . . . 64.01 111.055 168.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -71.97 -30.23 65.06 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.127 -0.942 . . . . 73.42 110.816 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.4 m-85 -83.97 -8.17 59.22 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.741 0.817 . . . . 72.31 112.271 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 9.1 t -61.9 -22.11 65.3 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.241 0.543 . . . . 73.45 110.291 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -86.05 108.55 18.31 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.212 -1.033 . . . . 64.43 108.212 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -75.54 -23.84 56.67 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.864 0.465 . . . . 74.35 110.595 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.1 m -67.9 -35.0 77.72 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.131 0.572 . . . . 74.42 110.58 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -64.07 -38.3 90.58 Favored 'General case' 0 C--O 1.25 1.11 0 C-N-CA 123.209 0.604 . . . . 73.33 110.096 175.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.497 HG23 HD11 ' A' ' 97' ' ' LEU . 32.8 mt -59.81 -56.73 15.42 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 123.816 0.698 . . . . 72.32 109.177 174.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -56.54 -38.22 71.56 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.361 0.664 . . . . 71.23 111.762 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 ttm180 -56.05 -59.18 5.28 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 124.664 1.228 . . . . 75.51 111.028 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.75 -25.6 56.67 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 116.058 -0.519 . . . . 75.42 110.206 -175.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.6 tp -74.13 -41.33 61.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.547 0.739 . . . . 74.51 110.03 -169.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -66.17 -22.76 66.37 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 123.434 0.459 . . . . 73.4 110.598 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 -28.91 19.2 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.056 0.943 . . . . 64.04 111.546 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.4 p . . . . . 0 N--CA 1.475 0.809 0 C-N-CA 122.917 0.487 . . . . 71.04 111.34 -174.01 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.417 HD11 ' HA ' ' A' ' 138' ' ' GLN . 3.0 mp . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 108.664 -0.865 . . . . 55.34 108.664 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.608 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 9.3 tp -56.48 -30.37 62.87 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 124.329 1.018 . . . . 62.11 112.074 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 28.1 m-85 -121.57 26.94 8.5 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 114.616 -1.174 . . . . 72.32 111.716 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -40.03 -63.71 0.58 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.398 1.079 . . . . 71.5 112.183 -169.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.48 -61.55 2.51 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.581 1.152 . . . . 72.13 111.86 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.43 HG13 ' HB2' ' A' ' 71' ' ' GLU . 96.9 t -59.79 -56.32 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.681 1.192 . . . . 72.21 111.685 -172.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.483 ' HB2' ' HB3' ' A' ' 98' ' ' PHE . 50.7 t30 -61.07 -33.63 73.64 Favored 'General case' 0 C--O 1.245 0.864 0 C-N-CA 124.926 1.29 . . . . 74.33 112.517 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -41.36 97.31 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 109.47 -0.567 . . . . 65.53 109.47 172.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -68.85 -31.9 71.19 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.786 -0.643 . . . . 73.44 112.442 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.81 -49.36 78.0 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.533 -0.543 . . . . 73.51 109.533 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.7 t -66.51 -32.77 74.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.806 0.842 . . . . 72.45 111.52 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 15.0 t70 -70.19 -51.39 31.47 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.656 0.783 . . . . 74.32 110.433 -178.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.5 -27.67 37.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-N 116.042 -0.526 . . . . 73.1 110.337 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 48.5 t-105 -69.42 -37.15 77.3 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 122.804 0.442 . . . . 75.34 111.462 174.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 32.5 pttt -66.49 -40.04 89.07 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 108.217 -1.031 . . . . 74.21 108.217 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 42.0 mt-10 -60.56 -47.96 83.87 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 123.526 0.516 . . . . 74.34 110.41 174.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.403 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -56.51 -61.36 2.46 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 124.842 1.339 . . . . 63.21 108.718 -177.599 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.4 t -49.26 -43.41 42.92 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.03 1.332 . . . . 52.45 111.274 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.419 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.4 mt -58.3 -66.15 0.53 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 123.832 0.708 . . . . 74.43 111.896 175.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.9 pp -62.93 -27.68 69.55 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.241 0.46 . . . . 64.43 112.241 -172.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.46 ' HB3' ' HE3' ' A' ' 122' ' ' MET . 95.1 mt -70.69 -48.36 55.11 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.067 0.947 . . . . 73.44 110.673 176.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -78.83 -20.68 49.06 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.508 0.323 . . . . 74.13 111.644 -175.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 114' ' ' LEU . 98.1 t -81.1 -55.38 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 110.014 -0.365 . . . . 60.42 110.014 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -87.56 -58.52 2.55 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 111.729 0.27 . . . . 54.42 111.729 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -76.81 -8.02 56.53 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.417 0.287 . . . . 74.52 111.239 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 58.31 32.88 22.6 Favored 'General case' 0 C--N 1.36 1.027 0 C-N-CA 124.621 1.168 . . . . 72.21 111.243 177.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.46 ' HE3' ' HB3' ' A' ' 116' ' ' LEU . 35.0 ttm -72.24 124.92 91.47 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 114.93 -1.032 . . . . 75.12 110.921 -174.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo . . . . . 0 C--N 1.367 1.533 0 C-N-CA 122.463 2.109 . . . . 74.53 110.984 178.327 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.419 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.7 m0 . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 114.258 1.207 . . . . 75.32 114.258 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.44 -39.48 46.67 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.672 0.272 . . . . 55.31 110.981 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.37 -47.73 69.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.656 0.782 . . . . 74.01 110.181 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.45 -63.04 1.37 Allowed 'General case' 0 C--N 1.355 0.809 0 CA-C-N 114.412 -1.267 . . . . 73.15 110.636 -170.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -56.21 -38.66 71.31 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.736 1.272 . . . . 74.21 112.66 -176.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLN . . . . . 0.417 ' HA ' HD11 ' A' ' 96' ' ' ILE . 6.4 tp-100 -58.18 -60.42 3.78 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.085 0.865 . . . . 75.42 110.43 178.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -68.73 -39.63 80.27 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.562 -0.745 . . . . 73.1 111.362 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.93 -57.98 10.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.929 1.692 . . . . 72.51 110.029 -177.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.404 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -75.29 -25.03 57.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 114.226 -1.352 . . . . 74.12 112.252 -174.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 22.0 t70 -61.09 -56.05 25.38 Favored 'General case' 0 C--N 1.349 0.58 0 O-C-N 123.724 0.64 . . . . 72.11 109.315 172.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.84 -33.36 75.8 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.488 1.117 . . . . 74.3 111.695 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 25.5 t0 -74.15 -32.63 63.22 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.197 0.311 . . . . 74.23 111.114 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -67.07 -37.05 83.31 Favored 'General case' 0 C--N 1.355 0.81 0 N-CA-C 109.222 -0.658 . . . . 73.44 109.222 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 10.8 mmt180 -63.77 -44.1 94.42 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.558 -0.534 . . . . 73.53 109.558 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.93 74.59 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.716 0.806 . . . . 72.33 111.862 -176.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.461 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -76.47 -61.65 1.89 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 109.842 -0.429 . . . . 65.01 109.842 178.926 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -68.82 -33.04 73.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.62 0.768 . . . . 73.25 111.173 -170.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.9 ttm -117.18 80.28 1.46 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.537 -1.282 . . . . 45.2 107.537 171.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 26.1 tp . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 122.115 0.96 . . . . 71.45 108.479 176.895 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 110.583 -0.154 . . . . 61.4 110.583 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.548 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 59.9 m-20 -56.38 -53.86 52.39 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 124.059 0.85 . . . . 74.03 110.784 175.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.7 mt -56.57 -46.36 80.82 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.999 0.812 . . . . 74.03 111.804 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -54.79 -47.61 73.77 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.618 0.574 . . . . 73.41 110.707 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -69.46 -42.17 75.24 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 118.826 -0.607 . . . . 75.35 112.415 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.08 -43.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 123.829 0.852 . . . . 62.22 110.514 -177.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 29.5 mm -67.69 -42.84 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.029 -0.987 . . . . 61.4 110.471 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.2 m -60.68 -48.98 79.34 Favored 'General case' 0 C--N 1.357 0.91 0 O-C-N 123.523 0.515 . . . . 61.33 110.539 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -55.12 -49.97 70.42 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 123.995 0.918 . . . . 75.31 110.119 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.96 -48.45 79.01 Favored Glycine 0 C--N 1.343 0.92 0 O-C-N 124.844 1.34 . . . . 74.24 112.973 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.1 mt-30 -62.44 -49.38 75.68 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.799 0.44 . . . . 73.03 111.284 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.9 -34.92 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.891 0.877 . . . . 62.3 110.764 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.473 HD11 ' O ' ' A' ' 69' ' ' LEU . 8.6 mt -62.92 -48.27 88.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.824 1.25 . . . . 71.2 110.505 177.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -62.76 -36.58 83.51 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 123.994 0.809 . . . . 63.23 110.355 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.8 mmmt -66.24 -48.17 71.4 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.669 0.605 . . . . 62.21 112.083 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -77.66 -17.99 57.16 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.346 0.258 . . . . 73.43 111.646 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.442 ' SG ' HD23 ' A' ' 31' ' ' LEU . 53.0 t -71.33 -22.24 61.94 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.58 0.752 . . . . 71.44 111.031 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.48 -16.69 64.31 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.722 0.409 . . . . 73.43 111.3 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -68.62 -17.18 64.06 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.124 0.57 . . . . 74.32 112.325 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.494 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 5.7 mmt -76.74 83.29 3.35 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.596 -0.52 . . . . 72.22 109.596 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -40.97 72.75 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.703 -1.221 . . . . 73.43 107.703 174.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -92.77 154.53 18.23 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.239 -1.346 . . . . 73.32 108.543 170.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 144' ' ' ASP . 80.9 m 58.97 58.83 3.02 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.977 0.894 . . . . 50.25 109.344 -171.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -73.36 -34.39 65.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 114.199 -1.364 . . . . 71.52 111.472 -169.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -81.74 -27.66 33.72 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.047 -0.723 . . . . 52.21 109.047 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.661 ' HG3' ' HG ' ' A' ' 97' ' ' LEU . 27.4 mm-40 -61.28 -40.65 94.92 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.423 0.689 . . . . 65.12 110.537 165.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 42.5 t -65.55 -36.17 83.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.692 0.797 . . . . 51.53 110.982 176.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -71.97 -31.95 66.78 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.207 0.603 . . . . 60.24 110.92 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.483 ' CZ ' ' HB3' ' A' ' 136' ' ' GLU . 21.5 mmt180 -69.14 -52.33 29.22 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.782 0.433 . . . . 64.05 110.373 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.442 HD23 ' SG ' ' A' ' 18' ' ' CYS . 29.7 tp -65.3 -38.85 91.49 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.62 0.575 . . . . 71.53 110.243 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.87 -54.41 38.2 Favored Glycine 0 C--N 1.346 1.111 0 O-C-N 123.691 0.619 . . . . 73.25 112.915 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -64.6 -44.37 90.83 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.848 0.859 . . . . 71.13 110.781 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.492 ' HG2' ' CE2' ' A' ' 133' ' ' TRP . 39.5 mtm180 -57.78 -60.6 3.45 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.084 0.865 . . . . 73.02 110.406 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.09 -51.58 69.08 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.576 0 O-C-N 124.311 1.007 . . . . 50.1 112.1 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.6 -45.65 93.21 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 118.064 0.393 . . . . 74.42 111.01 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -73.18 -18.36 79.19 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.943 -0.571 . . . . 71.42 113.448 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 12.6 tp -87.35 -40.01 14.82 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.52 0.728 . . . . 75.42 111.124 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.415 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 11.8 pt -79.73 -34.56 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 119.058 -0.496 . . . . 74.33 110.361 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -53.68 -50.64 82.34 Favored Pre-proline 0 CA--C 1.562 1.414 0 CA-C-O 117.929 -1.034 . . . . 75.02 113.415 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.64 -39.84 78.96 Favored 'Trans proline' 0 C--N 1.4 3.265 0 C-N-CA 121.699 1.6 . . . . 74.44 112.265 177.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 45' ' ' LEU . 4.0 mm? -69.48 -31.99 70.61 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.62 -0.718 . . . . 61.52 111.072 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 52.6 mt-10 -70.31 -38.9 75.05 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.065 0.546 . . . . 73.23 111.153 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.0 mtm -61.77 -46.13 90.92 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 123.625 0.578 . . . . 53.03 111.47 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 42' ' ' LEU . 3.7 pp -75.25 -33.06 61.25 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 116.323 -0.399 . . . . 75.23 111.007 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.7 -32.95 74.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.148 0.579 . . . . 74.22 110.572 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 . . . . . 0 N--CA 1.473 0.692 0 C-N-CA 123.936 0.894 . . . . 74.41 111.902 -179.022 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.524 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 28.9 m . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 119.865 -0.112 . . . . 74.1 111.033 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -61.07 -45.28 95.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.128 0.571 . . . . 64.22 111.111 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -59.08 -41.38 87.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.088 0.555 . . . . 75.4 110.878 176.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 55' ' ' SER . 12.2 tp -65.53 -48.77 71.34 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.641 -1.163 . . . . 74.14 110.151 -172.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.2 m -67.28 -39.27 86.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 114.915 -1.039 . . . . 71.11 111.05 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.9 m -65.62 -36.9 85.05 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.145 0.578 . . . . 64.14 111.256 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.28 -45.51 84.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.186 0.595 . . . . 74.21 109.774 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.548 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.8 mmt -68.71 -20.87 64.42 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.034 -0.985 . . . . 72.21 112.327 176.217 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -74.62 -42.86 57.85 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.242 0.617 . . . . 70.13 109.905 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.15 -41.5 98.34 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.287 0.635 . . . . 74.3 109.827 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.412 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -64.9 -50.99 64.34 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.396 -1.274 . . . . 65.43 109.75 -177.023 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -53.62 -49.37 67.99 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.311 1.044 . . . . 64.1 110.357 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.76 80.11 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.315 1.009 . . . . 72.25 111.773 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.59 -43.04 85.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.303 0.641 . . . . 61.4 110.862 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -70.36 -25.82 63.44 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.365 0.666 . . . . 75.35 111.559 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -65.25 -50.45 65.73 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.078 0.466 . . . . 55.3 109.949 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -64.61 -38.96 92.8 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 114.96 -1.018 . . . . 60.32 110.746 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.72 -47.33 85.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.082 0.553 . . . . 70.53 110.904 176.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.67 -38.46 81.55 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.155 0.91 . . . . 73.31 110.814 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.36 -42.04 75.79 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 123.962 0.789 . . . . 62.41 113.118 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.08 -41.59 94.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 122.605 0.362 . . . . 71.34 111.073 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 4.3 pt -80.76 -18.5 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.502 0.556 . . . . 63.52 112.502 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -64.68 -33.69 76.54 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.127 -0.694 . . . . 71.43 109.127 165.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -76.75 -39.53 51.44 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.754 -0.657 . . . . 71.3 110.894 173.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.518 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.4 m-30 -74.11 -12.4 60.59 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 112.867 0.692 . . . . 72.42 112.867 -177.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.2 p -61.0 -31.12 70.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.024 0.44 . . . . 64.32 110.276 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -89.65 115.87 27.35 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.179 -1.045 . . . . 74.5 108.179 167.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -74.35 -25.13 59.34 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.784 0.834 . . . . 72.32 110.992 -172.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -68.71 -34.45 75.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.628 0.771 . . . . 71.01 110.31 174.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.9 -35.54 74.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.398 0.679 . . . . 72.22 110.359 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.5 mt -58.65 -58.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 N-CA-C 108.827 -0.805 . . . . 73.52 108.827 171.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.0 t -53.0 -37.98 61.92 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.005 0.922 . . . . 41.0 111.825 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -62.6 -52.26 64.07 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-N 115.123 -0.944 . . . . 75.04 111.266 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -28.94 64.41 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.146 -0.316 . . . . 74.31 110.146 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 145' ' ' ARG . 11.5 tp -74.81 -39.36 61.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.695 1.198 . . . . 72.42 111.524 -166.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -67.22 -22.94 65.69 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.235 -0.893 . . . . 64.14 110.661 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.3 -10.2 17.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.509 0.724 . . . . 64.13 112.149 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 92.2 p . . . . . 0 N--CA 1.476 0.864 0 C-N-CA 122.682 0.393 . . . . 73.14 110.139 179.617 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.406 HG22 ' H ' ' A' ' 98' ' ' PHE . 2.5 mp . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 108.593 -0.892 . . . . 53.33 108.593 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.661 ' HG ' ' HG3' ' A' ' 27' ' ' GLN . 15.5 mt -65.19 -38.98 92.2 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 122.173 0.987 . . . . 75.44 110.093 177.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 56.7 m-85 -107.07 43.86 1.12 Allowed 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 113.715 -1.584 . . . . 71.31 109.445 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -63.46 -64.81 0.8 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.357 -0.979 . . . . 73.55 108.357 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.74 -42.82 85.65 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.785 -1.098 . . . . 74.34 110.302 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.49 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 50.0 t -59.65 -54.74 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 124.149 0.906 . . . . 73.13 111.278 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.406 HD21 ' HB3' ' A' ' 133' ' ' TRP . 65.2 t30 -72.07 -25.82 61.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 119.186 -0.435 . . . . 74.24 110.727 -176.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -61.0 -43.93 98.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 109.815 -0.439 . . . . 75.11 109.815 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.49 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 42.5 mttm -60.36 -57.45 12.72 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.902 0.881 . . . . 72.44 110.744 175.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.2 mp -54.6 -41.0 69.43 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.9 0.75 . . . . 75.12 111.348 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.2 t -71.64 -42.11 67.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.346 0.658 . . . . 43.54 111.264 -176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 17.7 t70 -71.93 -44.96 62.77 Favored 'General case' 0 C--O 1.254 1.305 0 O-C-N 123.623 0.577 . . . . 63.1 110.718 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.7 t -58.57 -49.74 81.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 CA-C-N 115.003 -0.999 . . . . 72.22 109.173 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -64.16 -29.07 70.21 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.011 0.819 . . . . 71.52 111.83 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.731 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 40.8 mtpt -56.69 -67.69 0.29 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 108.54 -0.911 . . . . 63.43 108.54 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.16 -29.84 71.11 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 124.084 0.865 . . . . 71.44 111.902 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.3 tt -72.52 -50.21 27.38 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.622 0.769 . . . . 74.42 110.142 -175.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.4 p -62.08 -37.6 85.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.446 0.298 . . . . 51.32 110.689 177.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 94.1 mt -60.11 -44.62 94.72 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.372 -0.831 . . . . 74.42 111.701 176.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -78.49 -21.8 48.43 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 112.23 0.456 . . . . 64.44 112.23 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 84.7 mt -63.97 -43.19 96.53 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.918 -0.771 . . . . 61.12 108.918 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -68.69 -47.47 66.34 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.698 0.799 . . . . 51.24 112.269 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.2 t -64.19 -60.65 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.23 0.612 . . . . 73.32 111.372 -177.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -86.32 -54.47 4.42 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.797 -0.638 . . . . 62.34 111.37 -168.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -88.37 -6.27 57.81 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.503 0.557 . . . . 74.45 112.503 -175.253 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 52.7 ttt85 66.16 7.57 4.91 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.854 1.262 . . . . 72.22 112.771 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 37.1 mtp -65.46 118.34 49.63 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.258 1.023 . . . . 65.52 111.423 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 C--N 1.377 2.051 0 C-N-CA 123.612 2.874 . . . . 71.14 112.559 -176.647 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.492 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 37.3 m0 . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 113.141 0.793 . . . . 72.33 113.141 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.46 -27.97 69.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.749 0.42 . . . . 64.03 111.612 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -88.81 -46.6 8.83 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.636 0.774 . . . . 62.21 110.705 174.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 49.8 mt-10 -64.11 -62.56 1.55 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.152 0.981 . . . . 72.22 111.6 -174.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -53.84 -34.07 58.18 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.871 0.869 . . . . 72.24 111.895 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -67.13 -52.04 46.56 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.109 0.564 . . . . 73.24 112.216 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.74 -48.69 80.67 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.556 0.535 . . . . 64.43 109.902 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.47 -38.31 86.8 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 114.248 -1.342 . . . . 64.23 110.313 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.0 97.6 Favored 'General case' 0 C--O 1.22 -0.46 0 O-C-N 124.121 0.888 . . . . 51.44 112.374 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.33 -47.78 84.36 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 109.181 -0.674 . . . . 74.15 109.181 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.93 -48.25 82.13 Favored 'General case' 0 CA--C 1.555 1.141 0 O-C-N 124.389 1.055 . . . . 74.11 111.35 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 24' ' ' CYS . 64.3 m-20 -70.33 -56.11 7.51 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.079 0.952 . . . . 62.43 112.378 -176.265 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.513 ' HG2' HD11 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -62.11 -43.07 99.65 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.318 1.047 . . . . 72.32 109.738 -173.696 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -63.45 -49.76 72.4 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 123.971 0.794 . . . . 75.43 109.632 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.73 70.71 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 112.312 0.486 . . . . 71.12 112.312 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -45.62 60.27 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.31 0.644 . . . . 70.42 109.555 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -76.51 -13.25 60.11 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 115.754 -0.657 . . . . 75.13 112.096 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 48.8 mtm -97.57 -77.59 0.5 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.084 -0.709 . . . . 63.53 109.084 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 N--CA 1.488 1.429 0 C-N-CA 124.907 1.283 . . . . 53.34 111.663 -172.375 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 119.642 -0.218 . . . . 75.32 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -55.42 -45.05 76.75 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.857 0.863 . . . . 64.22 110.535 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.12 -41.53 94.77 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.364 -0.834 . . . . 64.05 110.69 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -57.19 -43.4 82.63 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.746 0.654 . . . . 75.53 110.862 177.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -60.71 -55.71 29.95 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.619 0.574 . . . . 72.32 110.584 178.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.26 -49.39 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.817 0.847 . . . . 72.43 111.761 -177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 80.5 mt -71.12 -43.59 75.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.708 1.203 . . . . 73.41 111.197 -172.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 13' ' ' VAL . 97.5 m -63.45 -48.88 75.89 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.697 0.399 . . . . 65.31 110.536 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.1 mt -53.71 -50.36 66.07 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.05 0.843 . . . . 75.15 110.471 177.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.69 -52.31 46.56 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 124.602 1.189 . . . . 73.51 112.996 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.69 -48.24 82.45 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.773 0.429 . . . . 64.24 111.463 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 9' ' ' THR . 46.5 t -68.34 -25.24 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.086 0.554 . . . . 73.41 111.061 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.489 HD11 ' O ' ' A' ' 69' ' ' LEU . 33.4 mt -64.43 -48.4 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.83 0.852 . . . . 70.4 109.181 172.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.469 ' HB2' HG11 ' A' ' 35' ' ' VAL . 38.9 t-80 -59.37 -37.71 78.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.404 0.681 . . . . 74.03 111.134 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -63.75 -59.02 5.1 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.804 0.69 . . . . 74.23 110.966 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -74.69 -16.82 60.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.063 0.545 . . . . 75.31 111.755 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.63 -23.22 65.32 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.365 0.666 . . . . 73.11 111.289 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.96 -8.52 53.7 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.165 0.586 . . . . 73.33 111.653 178.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.85 -23.27 67.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.597 0.359 . . . . 63.01 111.153 170.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 7.2 mmt -74.88 87.44 2.28 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.697 -0.853 . . . . 72.3 108.697 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -36.09 75.13 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 107.359 -1.348 . . . . 72.53 107.359 168.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -89.72 175.91 7.06 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.622 -1.172 . . . . 74.21 108.454 171.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.613 ' SG ' HG21 ' A' ' 85' ' ' ILE . 99.9 m 57.79 74.03 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.796 0.685 . . . . 61.23 110.405 -172.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.76 -60.44 3.09 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.731 1.212 . . . . 73.21 110.585 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.569 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 57.5 mmtt -63.67 -49.46 73.07 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 115.145 -0.934 . . . . 75.24 110.381 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 14.0 mt-30 -60.55 -34.91 74.83 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.1 0.56 . . . . 75.23 112.243 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.4 t -74.21 -44.43 53.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.619 0.368 . . . . 72.14 110.948 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -65.79 -38.82 90.05 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 122.713 0.405 . . . . 74.42 110.911 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' NH2' ' HA ' ' A' ' 137' ' ' ASP . 18.2 mtp180 -67.9 -38.47 83.01 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.123 0.969 . . . . 64.03 110.627 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER -60.05 -50.81 72.24 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.995 0.81 . . . . 73.32 108.91 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -40.2 97.31 Favored Glycine 0 C--N 1.348 1.211 0 O-C-N 123.971 0.795 . . . . 64.13 113.202 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -57.0 -47.76 80.05 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.35 1.06 . . . . 74.43 110.71 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.412 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 69.5 mtt-85 -64.68 -48.78 73.47 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 114.726 -1.124 . . . . 73.41 110.753 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.469 HG11 ' HB2' ' A' ' 15' ' ' HIS . 41.7 t -54.09 -61.62 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.518 0 O-C-N 124.148 0.905 . . . . 60.42 111.185 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.488 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 72.2 mt -65.39 -46.42 80.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.074 0.859 . . . . 61.51 110.564 -172.329 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -37.78 76.97 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 116.058 -0.519 . . . . 74.3 113.069 176.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 65' ' ' PHE . 18.0 tp -84.33 -38.13 20.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.853 0.861 . . . . 73.45 112.471 -173.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.437 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 16.3 pt -75.46 -37.45 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 119.42 -0.324 . . . . 74.2 110.871 -176.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' A' ' 36' ' ' LEU . 5.6 mptp? -51.7 -51.81 66.59 Favored Pre-proline 0 N--CA 1.485 1.296 0 N-CA-C 114.021 1.119 . . . . 75.11 114.021 -174.501 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 19.6 Cg_endo -55.43 -37.52 94.74 Favored 'Trans proline' 0 C--N 1.395 3.007 0 C-N-CA 122.357 2.038 . . . . 64.43 112.669 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 -40.77 76.19 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.377 0.671 . . . . 72.33 110.658 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 92.7 mt-10 -66.74 -37.13 84.04 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.405 1.082 . . . . 74.42 111.299 -179.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 34.6 mmt -65.76 -40.15 91.77 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.728 0.642 . . . . 64.31 110.431 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -76.82 -38.26 54.18 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.281 -0.418 . . . . 62.34 110.403 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -39.2 87.65 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.485 0.714 . . . . 54.42 111.67 -178.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 . . . . . 0 N--CA 1.473 0.709 0 C-N-CA 123.866 0.866 . . . . 61.25 110.899 -178.196 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 109.684 -0.487 . . . . 71.11 109.684 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -59.98 -38.29 82.12 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.958 0.503 . . . . 74.41 110.735 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HG3' HD22 ' A' ' 58' ' ' LEU . 61.8 pttt -62.42 -37.27 85.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.371 0.668 . . . . 55.24 111.626 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 115' ' ' LEU . 4.0 mm? -65.96 -51.12 61.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.674 0.39 . . . . 73.12 110.172 175.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.5 m -58.67 -45.42 89.42 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.11 0.881 . . . . 70.15 111.229 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 51.0 m -59.73 -44.89 93.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.875 0.87 . . . . 65.32 110.212 176.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.67 -44.44 96.47 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.706 0.629 . . . . 75.41 111.494 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.6 mmt -67.45 -31.47 71.66 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.82 0.848 . . . . 61.31 111.141 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -74.29 -44.9 50.78 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.677 0.791 . . . . 73.22 111.057 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -61.25 -44.2 97.63 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.768 0.827 . . . . 73.14 109.727 175.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.46 ' HE1' HD21 ' A' ' 38' ' ' LEU . 3.4 t80 -59.62 -58.13 9.93 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 113.533 -1.667 . . . . 51.11 109.958 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.9 ttpp -52.71 -45.53 66.93 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 124.6 1.187 . . . . 73.2 110.913 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.82 79.03 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 124.311 1.007 . . . . 70.53 111.785 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.15 -34.8 71.34 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.339 0.656 . . . . 72.01 111.737 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.489 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -63.84 -40.12 95.84 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 122.554 0.342 . . . . 63.1 110.737 170.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 37.5 mt-10 -63.4 -42.07 98.77 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.151 0.58 . . . . 73.05 110.413 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 39.1 mt-10 -58.26 -54.65 44.65 Favored 'General case' 0 C--N 1.355 0.837 0 CA-C-N 114.907 -1.042 . . . . 71.22 110.124 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.19 -43.67 78.67 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.569 1.168 . . . . 74.41 111.884 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.06 -51.64 68.48 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 124.68 1.237 . . . . 54.2 109.854 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.04 -31.31 80.48 Favored Glycine 0 CA--C 1.535 1.282 0 CA-C-N 115.036 -0.984 . . . . 71.21 114.171 178.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 29.8 mm-40 -67.65 -56.42 9.45 Favored 'General case' 0 C--N 1.356 0.879 0 CA-C-N 116.947 0.373 . . . . 74.35 110.396 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -59.29 -28.26 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.937 -0.477 . . . . 74.43 111.43 175.557 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.07 -46.52 89.31 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.037 0.384 . . . . 52.21 112.037 171.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 14.1 ptpt -73.77 -25.29 60.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 117.852 0.296 . . . . 60.43 110.87 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.58 -2.41 57.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.541 0.736 . . . . 74.35 112.851 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.9 p -57.13 -31.14 65.02 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.978 0.511 . . . . 74.44 111.189 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -83.83 115.51 22.28 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 107.913 -1.143 . . . . 63.52 107.913 165.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -74.3 -23.02 59.03 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.482 0.713 . . . . 63.4 111.083 -172.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.8 p -59.82 -32.34 70.56 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.071 0.948 . . . . 71.53 111.765 171.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -63.17 -42.28 99.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.423 0.689 . . . . 64.03 110.327 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.613 HG21 ' SG ' ' A' ' 24' ' ' CYS . 52.5 mt -59.63 -58.7 5.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 114.812 -1.086 . . . . 63.32 109.44 178.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.0 t -56.5 -35.6 68.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.153 0.581 . . . . 74.32 111.693 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -57.38 -58.32 8.78 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.426 1.09 . . . . 53.32 111.621 178.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.405 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 1.7 p90 -75.47 -34.7 60.93 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.779 -0.452 . . . . 72.32 109.779 -177.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.32 -37.94 86.52 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.65 1.18 . . . . 75.25 111.503 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -66.67 -19.43 65.76 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.86 -0.609 . . . . 73.41 111.221 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.94 -23.0 14.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.101 0.96 . . . . 70.45 111.423 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 74.4 m . . . . . 0 N--CA 1.479 0.979 0 C-N-CA 124.368 1.067 . . . . 63.24 110.721 -174.308 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' A' ' 141' ' ' ALA . 14.1 mm . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 108.826 -0.805 . . . . 72.4 108.826 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.405 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 2.0 tp -50.54 -43.71 56.2 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.632 0.729 . . . . 75.31 111.582 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 3.5 m-85 -118.05 25.09 10.58 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 114.421 -1.263 . . . . 55.34 110.797 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -40.34 -56.95 1.87 Allowed 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 124.535 1.134 . . . . 63.4 112.559 -167.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.96 -55.32 8.59 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.184 0.993 . . . . 65.03 111.074 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.4 -46.1 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 124.29 1.036 . . . . 71.11 111.954 -174.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.412 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 51.0 t30 -76.38 -28.73 56.87 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.983 1.313 . . . . 73.13 110.407 -177.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -62.48 -39.4 93.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 109.85 -0.426 . . . . 71.41 109.85 168.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -68.39 -36.94 79.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.38 0.672 . . . . 64.4 110.464 175.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.84 -39.15 90.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.854 0.461 . . . . 72.01 110.777 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 66.1 m -72.6 -41.06 66.02 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.368 0.667 . . . . 71.12 111.209 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.497 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 15.9 t70 -80.1 -36.3 35.63 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.748 0.419 . . . . 70.44 110.599 -176.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.2 t -69.85 -28.78 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 110.084 -0.339 . . . . 63.34 110.084 172.212 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -69.43 -34.84 75.03 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 119.333 -0.365 . . . . 70.52 110.703 170.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 51.8 mtpt -57.22 -57.61 11.85 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 109.616 -0.513 . . . . 71.12 109.616 171.158 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.2 mt-10 -51.72 -47.18 64.09 Favored 'General case' 0 C--N 1.358 0.94 0 O-C-N 124.447 1.092 . . . . 72.55 110.415 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -64.08 -60.46 3.21 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 124.176 0.99 . . . . 72.4 109.965 -173.057 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -53.27 -38.94 63.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.065 0.946 . . . . 63.52 111.513 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 118' ' ' VAL . 96.6 mt -60.2 -62.78 1.61 Allowed 'General case' 0 CA--C 1.545 0.777 0 O-C-N 123.703 0.627 . . . . 65.33 111.149 175.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 58' ' ' LEU . 2.5 pp -65.9 -23.15 66.58 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.724 0.639 . . . . 72.23 112.724 -176.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.419 HD13 ' SD ' ' A' ' 122' ' ' MET . 80.8 mt -72.86 -42.28 63.84 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 123.483 0.713 . . . . 71.44 110.001 175.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -75.77 -26.01 56.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.506 0.322 . . . . 63.24 111.402 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 114' ' ' LEU . 77.8 t -75.25 -61.81 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.695 -0.483 . . . . 64.32 109.695 177.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -59.02 2.37 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.977 0.511 . . . . 75.31 110.066 -170.196 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.4 ' OE1' ' HA ' ' A' ' 116' ' ' LEU . 27.8 mp0 -76.85 -14.09 59.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.241 0.616 . . . . 74.4 111.569 -174.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 63.65 22.84 13.3 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 124.884 1.274 . . . . 75.44 111.04 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.528 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 48.6 ttm -55.45 115.41 9.24 Favored Pre-proline 0 C--N 1.357 0.894 0 C-N-CA 124.654 1.182 . . . . 71.54 111.999 -173.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--N 1.367 1.502 0 C-N-CA 122.108 1.872 . . . . 61.4 109.72 172.566 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.404 ' HH2' HD22 ' A' ' 38' ' ' LEU . 11.3 m0 . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 113.286 0.847 . . . . 75.31 113.286 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.52 -40.76 18.76 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.781 -0.574 . . . . 70.21 110.721 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -73.35 -39.05 65.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.989 -1.005 . . . . 71.4 111.481 -171.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' ' 140' ' ' ASP . 41.7 mt-10 -52.59 -56.82 12.63 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 124.917 1.287 . . . . 75.14 111.068 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.498 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 3.5 m-20 -63.5 -57.64 9.57 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.031 -0.986 . . . . 74.1 112.368 -172.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -59.23 -58.89 6.66 Favored 'General case' 0 CA--C 1.561 1.404 0 O-C-N 123.062 0.226 . . . . 75.51 111.406 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.82 -56.19 6.87 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 122.36 0.264 . . . . 74.2 110.63 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 136' ' ' GLU . 5.5 m-20 -74.99 -28.84 60.7 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.299 -0.858 . . . . 71.43 112.254 -170.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.501 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -78.89 -24.44 44.2 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.655 1.116 . . . . 74.13 110.967 176.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -65.84 -47.03 76.37 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 109.745 -0.465 . . . . 75.14 109.745 167.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.69 -39.66 77.66 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.952 0.901 . . . . 64.1 110.781 175.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 29.8 t0 -75.02 -42.93 56.32 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.198 0.999 . . . . 71.1 111.906 -172.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 61.6 ttt-85 -64.7 -41.7 95.83 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.1 -0.954 . . . . 71.14 109.719 178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -65.09 -34.9 79.51 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.186 -0.915 . . . . 71.32 110.806 172.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.56 -19.56 59.22 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.855 0.462 . . . . 73.52 111.491 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.63 -58.79 3.06 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.866 -0.79 . . . . 64.03 108.866 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -70.14 -46.72 64.13 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.587 0.755 . . . . 54.01 111.494 -175.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 75.3 mtp -96.86 36.25 1.43 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.572 0.749 . . . . 72.34 110.397 -178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 50.5 tp . . . . . 0 CA--C 1.547 0.832 0 C-N-CA 123.703 0.801 . . . . 65.14 110.702 -179.701 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.553 -0.166 . . . . 75.14 110.553 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -61.07 -41.01 95.83 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.885 0.74 . . . . 71.54 109.484 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.425 HD11 HD12 ' A' ' 42' ' ' LEU . 3.6 mm? -58.17 -52.11 66.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.303 0.641 . . . . 75.34 110.409 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -53.85 -38.67 64.91 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.135 0.574 . . . . 72.31 111.083 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.417 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.5 t-80 -65.88 -49.5 67.85 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 123.805 0.691 . . . . 75.3 110.49 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.96 -52.58 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 124.876 1.27 . . . . 71.21 111.477 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -64.71 -40.87 90.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.035 0.934 . . . . 70.34 110.693 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 55.3 m -62.75 -42.5 99.71 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.693 0.397 . . . . 72.22 110.75 176.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 79.6 mt -57.4 -56.65 19.09 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.37 0.419 . . . . 72.12 110.084 177.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.4 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -62.58 -35.7 92.18 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 124.279 0.987 . . . . 63.11 113.827 -176.291 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.447 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 4.5 tp-100 -70.38 -49.5 48.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 109.636 -0.505 . . . . 74.13 109.636 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.99 -33.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.564 0.746 . . . . 72.02 110.774 175.503 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.4 HD12 ' HA2' ' A' ' 11' ' ' GLY . 23.1 mt -54.61 -55.96 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.949 0.9 . . . . 64.5 109.768 173.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -60.39 -38.7 84.79 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 124.155 0.909 . . . . 71.42 111.686 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 13.5 mptt -60.84 -54.64 42.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.008 0.923 . . . . 63.23 111.918 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -79.48 -19.22 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.461 0.704 . . . . 62.22 111.989 -175.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.6 t -64.33 -17.81 64.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.365 1.066 . . . . 75.41 113.068 177.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -55.42 -20.63 12.82 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 123.961 0.905 . . . . 72.31 112.915 175.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -62.8 -29.87 71.04 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.408 0.683 . . . . 73.31 112.472 175.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.422 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 8.3 mmt -78.45 81.83 4.76 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.101 0.477 . . . . 44.11 110.679 -173.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -80.55 -34.51 35.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.139 -1.06 . . . . 60.32 108.139 169.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.45 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 85.7 m-85 -90.81 153.32 20.32 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 114.186 -1.37 . . . . 71.42 108.217 170.099 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m 57.81 70.99 0.61 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.369 1.08 . . . . 53.53 109.536 -166.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' H ' ' HD2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -75.08 -48.69 22.65 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 113.803 -1.544 . . . . 53.43 109.411 -170.559 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.0 mptp? -61.68 -37.37 83.84 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 109.416 -0.587 . . . . 75.21 109.416 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.77 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 16.0 mm-40 -66.25 -43.85 85.37 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 117.862 0.301 . . . . 51.33 111.16 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 52.7 t -66.78 -43.02 85.08 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.906 0.882 . . . . 73.12 111.874 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.3 mpt_? -80.93 -33.55 33.97 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.557 0.743 . . . . 72.43 111.033 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.511 ' NH2' ' HB2' ' A' ' 136' ' ' GLU . 25.6 tpt180 -73.16 -38.63 66.15 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.185 -0.672 . . . . 51.0 109.185 176.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.73 -46.33 90.11 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 123.815 0.697 . . . . 74.12 109.159 173.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.2 -46.22 93.07 Favored Glycine 0 C--N 1.349 1.298 0 O-C-N 123.879 0.737 . . . . 54.44 112.63 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -60.46 -52.82 63.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.453 0.701 . . . . 52.01 110.452 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.54 HH12 ' HB2' ' A' ' 106' ' ' SER . 16.3 mtt180 -58.81 -63.4 1.31 Allowed 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.094 0.871 . . . . 60.15 110.547 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 39' ' ' ILE . 55.8 t -50.93 -50.57 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.305 1.042 . . . . 70.05 111.942 -175.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -62.46 -41.54 98.83 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 123.369 0.418 . . . . 71.25 111.188 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.55 -23.55 72.12 Favored Glycine 0 N--CA 1.474 1.17 0 CA-C-N 116.325 -0.398 . . . . 61.5 113.34 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.571 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 27.6 mt -87.2 -46.98 9.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 54.2 111.301 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 35' ' ' VAL . 23.0 pt -80.47 -41.55 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 117.933 -1.032 . . . . 64.34 111.917 -170.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -54.77 -48.27 95.97 Favored Pre-proline 0 N--CA 1.497 1.891 0 N-CA-C 113.724 1.009 . . . . 75.43 113.724 -174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -54.76 -39.36 89.94 Favored 'Trans proline' 0 C--N 1.391 2.785 0 C-N-CA 122.1 1.866 . . . . 61.33 112.868 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 45' ' ' LEU . 4.2 mm? -77.08 -29.39 54.97 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.224 -0.898 . . . . 75.21 111.359 178.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -67.22 -38.14 84.76 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.323 0.649 . . . . 62.03 109.973 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 67.3 mtm -62.07 -50.77 70.65 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.779 0.675 . . . . 75.02 111.019 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 42' ' ' LEU . 4.4 pp -76.51 -22.77 54.0 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.698 0.399 . . . . 65.33 111.967 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -71.24 -41.15 70.51 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.608 0.763 . . . . 72.45 110.211 174.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.481 1.077 0 C-N-CA 123.909 0.884 . . . . 75.42 108.882 -177.912 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 N--CA 1.468 0.439 0 N-CA-C 108.12 -1.066 . . . . 61.33 108.12 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -62.74 -44.73 95.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 122.495 0.318 . . . . 71.01 110.875 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.86 -37.28 76.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.388 0.675 . . . . 64.04 111.147 175.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 2.8 tm? -70.94 -47.66 57.77 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 124.11 0.964 . . . . 64.24 109.392 -175.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.3 m -64.46 -40.57 95.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.08 0.862 . . . . 43.24 110.857 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.8 m -58.52 -49.11 78.58 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.788 0.835 . . . . 73.15 110.756 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.09 98.64 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.722 0.809 . . . . 53.13 111.0 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.6 mmt -67.84 -33.62 75.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.668 0.787 . . . . 74.12 111.14 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -73.27 -35.88 66.26 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.544 0.737 . . . . 64.35 110.751 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.278 0.631 . . . . 61.43 110.112 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.571 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 2.5 t80 -67.17 -45.91 75.56 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.116 1.366 . . . . 70.11 109.507 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.2 ttpp -58.32 -51.29 70.4 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.812 -1.54 . . . . 72.03 110.009 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.72 -43.2 76.3 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.177 0.923 . . . . 52.32 111.392 -178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.572 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.8 -42.63 99.26 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 114.984 -1.007 . . . . 74.51 111.639 177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -74.41 -25.8 59.68 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.931 0.492 . . . . 72.33 112.3 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 62.1 mt-10 -67.11 -44.04 80.95 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.619 0.724 . . . . 64.22 109.341 174.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.1 mt-10 -67.53 -43.18 81.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.509 -1.223 . . . . 62.24 111.01 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.57 -40.26 96.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.466 0.707 . . . . 62.2 111.23 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.42 -43.43 98.88 Favored 'General case' 0 C--N 1.351 0.64 0 O-C-N 124.235 0.959 . . . . 75.1 109.758 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.2 -33.34 86.98 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.555 -0.748 . . . . 62.34 113.89 175.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 26.0 mm-40 -63.69 -57.94 8.45 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.998 -0.371 . . . . 73.14 109.998 178.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.563 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -66.7 -20.13 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.62 0.6 . . . . 74.3 112.62 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.74 -49.56 75.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.104 -0.702 . . . . 72.23 109.104 171.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -80.83 -25.97 37.36 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 111.811 0.3 . . . . 74.14 111.811 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.563 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.7 m-30 -77.81 -5.21 50.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.595 0.758 . . . . 74.32 112.131 -178.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.8 p -55.91 -30.71 62.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.244 0.617 . . . . 74.42 110.178 173.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -81.76 107.55 14.58 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 108.657 -0.868 . . . . 62.43 108.657 167.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -68.26 -25.82 65.36 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.345 0.658 . . . . 75.2 110.749 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.7 p -71.23 -33.02 69.47 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 43.15 111.336 175.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.95 -40.57 98.08 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.566 0.746 . . . . 65.23 110.047 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.65 HG23 HD11 ' A' ' 97' ' ' LEU . 32.3 mt -57.87 -61.25 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.846 0 CA-C-N 114.83 -1.077 . . . . 73.23 109.911 175.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.99 -40.57 61.15 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.976 0.91 . . . . 72.24 111.971 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 47.3 tpt85 -58.92 -56.68 19.11 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.449 -1.25 . . . . 63.21 111.754 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -21.27 51.66 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 110.219 -0.289 . . . . 71.33 110.219 -177.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.505 HD23 HE22 ' A' ' 149' ' ' GLN . 17.3 tp -73.3 -40.81 64.24 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.932 0.893 . . . . 72.01 110.576 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -67.11 -23.92 65.88 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.026 0.441 . . . . 53.54 110.607 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.33 -0.26 41.5 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.591 1.156 . . . . 71.24 111.8 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.6 t . . . . . 0 N--CA 1.474 0.742 0 C-N-CA 123.279 0.632 . . . . 53.02 110.369 -176.252 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.6 HD13 ' HG2' ' A' ' 99' ' ' LYS . 3.1 mp . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.825 -0.435 . . . . 74.33 109.825 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.77 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.9 tp -62.97 -39.75 95.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.237 1.015 . . . . 74.31 111.096 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.403 ' H ' HG22 ' A' ' 96' ' ' ILE . 39.1 m-85 -103.56 17.74 23.42 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 114.354 -1.294 . . . . 72.42 111.016 -175.656 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 96' ' ' ILE . 2.1 tmtp? -35.45 -64.27 0.3 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 124.78 1.232 . . . . 74.52 113.571 -157.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 25.8 t70 -61.82 -48.84 78.77 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 124.044 0.84 . . . . 54.53 110.797 -175.373 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.19 -44.95 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.85 . . . . 74.32 111.268 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -75.43 -25.93 57.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.599 0.76 . . . . 72.12 110.221 -175.645 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.65 -38.64 89.91 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.827 -0.805 . . . . 74.24 108.827 170.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 100' ' ' ASP . 1.4 mptm? -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 118.855 -0.593 . . . . 72.04 110.846 172.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.5 mp -58.12 -43.76 87.38 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 119.275 0.943 . . . . 74.14 110.389 172.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.54 ' HB2' HH12 ' A' ' 34' ' ' ARG . 9.5 t -67.33 -51.62 50.16 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.421 0.688 . . . . 70.52 111.256 -175.086 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 14.0 t70 -69.26 -50.02 50.81 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.531 -1.213 . . . . 73.02 110.11 -174.174 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.56 -35.95 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 118.944 -0.55 . . . . 75.03 110.806 -178.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -60.6 -48.52 81.39 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 118.373 0.533 . . . . 73.23 110.567 176.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.42 -37.08 84.41 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 118.931 -0.557 . . . . 75.45 110.961 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.5 mm-40 -61.42 -48.23 82.15 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.265 0.484 . . . . 52.22 111.398 175.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.0 tt -64.79 -51.93 59.55 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.294 1.438 . . . . 65.43 109.733 -175.528 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.9 t -60.78 -42.24 97.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.802 1.241 . . . . 71.23 111.538 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.2 -55.88 27.1 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 119.342 -0.361 . . . . 65.44 110.86 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 4.5 pp -61.53 -29.82 70.24 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.579 0.228 . . . . 71.1 111.571 -177.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.558 HD22 ' SD ' ' A' ' 122' ' ' MET . 58.9 mt -62.42 -53.63 52.01 Favored 'General case' 0 C--N 1.359 0.99 0 CA-C-N 115.813 -0.63 . . . . 71.53 111.126 171.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -68.88 -35.1 76.48 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.979 0.512 . . . . 73.41 111.839 -175.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.61 -58.68 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.183 0.593 . . . . 63.43 110.512 -177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -97.05 -56.42 2.56 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.354 0.502 . . . . 64.34 112.354 -171.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -71.46 -14.87 62.27 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 112.128 0.418 . . . . 71.35 112.128 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 60.53 23.53 13.22 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.842 1.257 . . . . 74.51 111.975 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.558 ' SD ' HD22 ' A' ' 116' ' ' LEU . 64.4 mtp -79.96 118.26 71.52 Favored Pre-proline 0 C--N 1.351 0.666 0 C-N-CA 124.408 1.083 . . . . 75.1 109.552 179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 C--N 1.372 1.81 0 C-N-CA 123.148 2.565 . . . . 62.34 111.882 -177.271 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 11.0 t90 . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 120.473 0.178 . . . . 65.22 110.888 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.23 -20.63 65.71 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.793 0.837 . . . . 73.44 112.145 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 138' ' ' GLN . 67.3 mt-30 -77.68 -34.23 53.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.32 0.648 . . . . 70.44 110.27 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . 45.2 mt-10 -64.88 -42.19 95.01 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 109.236 -0.653 . . . . 73.44 109.236 173.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -56.52 -44.72 81.07 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.886 0.741 . . . . 74.14 111.836 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 12.6 pt20 -76.17 -30.7 58.19 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.387 0.429 . . . . 64.43 111.58 -176.401 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -65.63 -53.05 46.88 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.654 0.782 . . . . 74.13 110.253 174.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.8 -46.88 77.91 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 114.534 -1.212 . . . . 71.35 111.221 175.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.2 -29.26 68.07 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.821 0.849 . . . . 22.54 112.808 -177.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.36 -49.62 66.29 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.157 0.503 . . . . 64.21 109.988 175.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.7 -31.69 73.03 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.382 -1.281 . . . . 72.04 111.605 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.7 t0 -79.55 -41.44 27.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.058 0.943 . . . . 71.33 111.509 -175.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 53.8 ttt180 -66.6 -37.16 84.32 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.731 . . . . 64.24 109.629 176.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -68.7 -35.64 77.45 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.317 -0.856 . . . . 70.35 110.829 171.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -23.96 61.31 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.664 0.386 . . . . 63.14 111.172 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.3 OUTLIER -79.7 -60.82 2.2 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.31 0.644 . . . . 63.4 110.011 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 149' ' ' GLN . . . . . 0.505 HE22 HD23 ' A' ' 89' ' ' LEU . 2.0 mp0 -71.03 -45.35 64.06 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.841 0.456 . . . . 73.21 111.186 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ttm -99.88 60.38 1.09 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.016 -1.105 . . . . 44.2 108.016 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 30.9 tp . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.17 0.986 . . . . 72.22 109.311 179.531 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 CA--C 1.552 1.037 0 CA-C-O 119.547 -0.264 . . . . 71.52 111.669 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.21 -45.22 61.82 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.465 0.706 . . . . 73.13 110.314 172.753 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.0 mm? -65.06 -41.56 95.01 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 115.153 -0.93 . . . . 70.34 110.675 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -57.82 -46.55 84.54 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 109.605 -0.517 . . . . 65.41 109.605 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -60.79 -55.46 32.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.757 0.66 . . . . 71.12 110.859 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.7 mt -57.42 -53.95 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.724 0.809 . . . . 73.42 112.167 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.509 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -61.07 -44.34 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.301 1.04 . . . . 72.31 110.511 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 95.9 m -63.73 -46.38 85.64 Favored 'General case' 0 C--N 1.358 0.952 0 C-N-CA 122.88 0.472 . . . . 72.14 111.262 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.8 -46.28 87.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.466 0.706 . . . . 60.24 110.936 -178.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.419 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.2 -49.93 71.1 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 124.608 1.193 . . . . 64.55 111.966 178.043 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.4 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 70.8 mt-30 -56.09 -46.72 78.95 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.962 0.505 . . . . 70.3 111.365 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.2 -38.32 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.789 0.836 . . . . 73.3 111.15 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.25 -53.59 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.771 0.828 . . . . 62.24 110.197 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -60.73 -33.05 72.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.848 0.859 . . . . 74.54 111.43 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.7 mptm? -75.22 -53.17 9.25 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.293 0.637 . . . . 72.31 111.186 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.477 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 12.1 ptm180 -66.93 -30.44 70.58 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 111.753 0.279 . . . . 73.21 111.753 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.1 t -59.76 -17.89 38.93 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.861 1.264 . . . . 61.02 112.995 -175.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -53.32 -23.57 9.59 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.602 0.761 . . . . 60.34 112.332 173.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.72 -13.28 61.97 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.197 0.999 . . . . 71.54 112.066 -178.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.1 mmt -76.3 96.35 3.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.514 -0.551 . . . . 75.34 109.514 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -29.42 39.35 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.456 -0.942 . . . . 75.2 108.456 174.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.407 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 43.6 m-85 -99.97 175.99 5.58 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.439 1.096 . . . . 75.11 110.194 169.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' HG21 ' A' ' 85' ' ' ILE . 70.9 m 53.67 79.5 0.13 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.385 1.053 . . . . 64.11 110.138 -171.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -73.86 -61.21 1.93 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.551 -0.749 . . . . 75.25 109.591 -170.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 48.8 mttm -67.15 -39.52 86.55 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 114.416 -1.266 . . . . 74.3 111.781 -174.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.462 ' HG2' HH22 ' A' ' 30' ' ' ARG . 45.7 mt-30 -71.22 -31.45 67.6 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.07 0.548 . . . . 53.13 111.84 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 53.2 t -76.63 -40.79 48.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.315 0.646 . . . . 53.42 110.692 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 mtp-105 -65.39 -38.35 89.72 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.219 0.608 . . . . 74.24 110.657 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.629 HH22 ' HB2' ' A' ' 141' ' ' ALA . 6.5 mtp180 -66.44 -44.42 82.92 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.175 -0.917 . . . . 72.2 109.939 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 ' SG ' ' A' ' 18' ' ' CYS . 55.5 tp -56.08 -49.29 74.22 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.71 0.631 . . . . 72.33 110.776 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.36 -45.87 92.42 Favored Glycine 0 C--N 1.351 1.388 0 O-C-N 123.989 0.806 . . . . 53.5 112.166 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -60.93 -42.55 98.4 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.309 1.043 . . . . 74.52 111.49 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 57.1 mtt180 -59.22 -61.04 2.93 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.7 -0.852 . . . . 75.4 108.7 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.3 t -51.09 -49.04 29.74 Favored 'Isoleucine or valine' 0 C--N 1.353 0.75 0 O-C-N 125.47 1.731 . . . . 55.03 111.636 -175.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 97.1 mt -61.12 -43.61 98.62 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 124.097 0.873 . . . . 62.03 111.063 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.88 -25.59 74.18 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.553 0.533 . . . . 51.13 113.354 176.536 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.518 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 20.0 mt -82.89 -43.12 16.93 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.204 0.602 . . . . 62.12 111.127 -177.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.419 HG21 ' HA3' ' A' ' 11' ' ' GLY . 12.1 pt -79.07 -30.98 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.43 -0.795 . . . . 73.21 110.544 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 57.2 tptt -43.07 -59.45 3.11 Favored Pre-proline 0 N--CA 1.494 1.772 0 C-N-CA 124.346 1.058 . . . . 74.4 113.127 -178.178 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 26.0 Cg_exo -65.8 -31.62 47.98 Favored 'Trans proline' 0 C--N 1.392 2.835 0 C-N-CA 122.133 1.888 . . . . 74.42 112.609 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.4 mm? -79.44 -25.06 42.06 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.415 0.686 . . . . 74.12 110.768 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -73.01 -36.3 66.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.345 0.658 . . . . 74.14 109.324 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.7 mmt -63.79 -24.55 67.8 Favored 'General case' 0 N--CA 1.482 1.139 0 O-C-N 123.74 0.65 . . . . 64.33 110.529 175.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 77.2 mt -73.83 -64.01 1.09 Allowed 'General case' 0 C--N 1.355 0.814 0 N-CA-C 109.276 -0.639 . . . . 73.42 109.276 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -54.71 -34.65 62.71 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.182 0.808 . . . . 73.1 113.182 -167.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 122.403 0.281 . . . . 74.44 111.7 176.972 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 110.326 -0.25 . . . . 52.0 110.326 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -58.85 -45.17 90.71 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.978 0.511 . . . . 70.32 111.126 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -70.79 -34.68 72.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.279 0.631 . . . . 65.41 111.867 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.562 HD22 HD13 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -59.82 -49.26 78.42 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.182 -1.044 . . . . 73.14 108.182 176.681 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -64.98 -35.18 80.36 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.482 1.113 . . . . 61.45 111.014 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.2 m -59.33 -48.26 82.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.845 0.458 . . . . 73.34 110.54 176.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.98 -40.6 94.07 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.833 0.708 . . . . 73.21 110.98 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.97 -41.36 97.91 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.542 0.737 . . . . 73.21 111.836 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -69.78 -39.1 76.83 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.444 0.698 . . . . 65.42 110.719 -178.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -65.76 -37.96 87.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.408 0.683 . . . . 75.22 110.884 176.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 1.7 t80 -70.05 -43.49 71.14 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.882 0.739 . . . . 73.22 109.969 -177.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -58.99 -50.26 74.76 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.669 1.188 . . . . 65.5 110.825 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.91 -41.42 97.9 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 124.019 0.824 . . . . 72.14 111.241 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.433 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -63.88 -38.88 92.73 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.88 0.737 . . . . 42.11 111.169 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.68 -43.71 92.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.084 0.554 . . . . 73.52 110.886 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.72 -34.02 76.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.451 0.701 . . . . 62.54 111.095 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 36.9 mm-40 -69.3 -42.93 74.78 Favored 'General case' 0 C--N 1.351 0.634 0 O-C-N 123.603 0.564 . . . . 72.14 111.349 175.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.48 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.066 0.546 . . . . 44.43 111.173 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -60.36 -44.54 95.49 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.17 0.988 . . . . 61.32 109.641 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -62.11 -36.73 93.37 Favored Glycine 0 C--N 1.347 1.183 0 O-C-N 124.239 0.962 . . . . 74.0 112.916 176.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 18.2 mm-40 -62.75 -56.93 13.13 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 117.273 0.536 . . . . 63.41 110.16 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.9 pt -65.56 -18.98 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 112.169 0.433 . . . . 54.31 112.169 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.477 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 27.2 tt0 -70.91 -39.91 72.45 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 122.691 0.396 . . . . 74.54 110.653 173.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 48.9 mttm -74.98 -30.23 61.12 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.899 0.381 . . . . 72.54 110.467 175.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.0 m-85 -81.36 0.03 39.12 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.662 0.785 . . . . 64.35 112.228 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.6 p -55.75 -34.79 65.52 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.82 0.819 . . . . 61.34 110.955 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.484 ' HB2' ' ND2' ' A' ' 84' ' ' ASN . 21.6 m-80 -93.67 113.5 25.6 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.164 -1.421 . . . . 54.42 107.164 168.186 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -69.76 -21.53 63.43 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.941 0.896 . . . . 74.52 110.843 -171.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.3 m -63.13 -33.46 75.5 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.917 0.887 . . . . 72.21 111.691 173.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 81' ' ' ASN . 88.3 m-20 -67.09 -38.3 85.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.264 0.626 . . . . 72.31 110.228 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 97' ' ' LEU . 52.2 mt -55.72 -60.86 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.967 0 O-C-N 124.082 0.864 . . . . 74.23 109.197 172.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 52.7 t -53.82 -37.78 63.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.08 0.952 . . . . 35.34 111.63 -177.778 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -58.78 -57.54 12.58 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.429 1.08 . . . . 44.55 111.033 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.51 -28.2 56.31 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 110.366 -0.235 . . . . 75.34 110.366 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -68.43 -39.7 81.43 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.454 1.102 . . . . 74.5 110.934 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.9 t -65.26 -31.25 72.31 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.626 0.579 . . . . 73.31 110.956 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.23 -1.26 31.58 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.833 0.853 . . . . 70.34 111.64 -177.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.471 0.608 0 C-N-CA 123.493 0.717 . . . . 70.43 111.139 -175.348 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.605 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 4.2 mp . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 107.696 -1.224 . . . . 62.25 107.696 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.675 HD11 HG23 ' A' ' 85' ' ' ILE . 10.9 tp -62.97 -29.6 70.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.062 0.945 . . . . 74.14 112.734 -172.197 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.441 ' H ' HG22 ' A' ' 96' ' ' ILE . 52.2 m-85 -120.33 8.63 10.85 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 117.999 -1.001 . . . . 71.45 111.211 -174.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.605 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 28.2 ttpt -35.68 -59.59 0.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 114.724 1.379 . . . . 44.34 114.724 -156.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 31.3 t70 -66.89 -42.98 84.61 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.63 0.772 . . . . 60.03 111.563 -175.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.59 -38.02 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.242 0.617 . . . . 65.32 110.179 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -80.27 -18.16 50.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.42 0.688 . . . . 61.42 110.233 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -73.68 -34.0 64.69 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.505 -0.924 . . . . 75.02 108.505 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 48.3 mttm -62.9 -46.47 87.68 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.482 -0.562 . . . . 72.14 109.482 170.01 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.433 HD22 ' HB1' ' A' ' 68' ' ' ALA . 3.8 mm? -56.23 -43.29 78.47 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 123.336 0.397 . . . . 63.25 110.902 173.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t -70.46 -34.95 73.01 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.332 0.653 . . . . 50.41 111.332 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 18.0 t70 -72.27 -55.53 7.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.982 0.913 . . . . 72.41 109.496 -176.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.87 -53.76 38.33 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 114.907 -1.042 . . . . 74.43 109.598 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -61.5 -37.97 85.61 Favored 'General case' 0 C--N 1.357 0.93 0 CA-C-O 118.364 -0.827 . . . . 75.2 112.831 -175.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.7 ptmt -65.39 -47.64 75.65 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.556 1.071 . . . . 73.2 108.921 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.03 -35.59 80.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 120.93 0.395 . . . . 60.1 110.899 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 7.3 tt -72.82 -44.42 61.5 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.803 1.241 . . . . 62.14 110.023 -173.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 31.1 t -67.4 -40.93 85.66 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.349 0.66 . . . . 74.12 109.444 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 92.5 mt -64.13 -39.74 94.68 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 123.504 0.502 . . . . 73.43 112.019 178.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.562 HD13 HD22 ' A' ' 58' ' ' LEU . 4.2 pp -73.88 -25.25 59.93 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.064 0.393 . . . . 71.13 110.515 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.571 HD13 ' SD ' ' A' ' 122' ' ' MET . 89.8 mt -69.67 -32.01 70.4 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 119.61 -0.233 . . . . 72.12 110.393 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 113' ' ' SER . 24.0 mm-40 -67.21 -52.35 42.22 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.803 0.441 . . . . 65.41 110.063 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -76.26 -60.31 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.326 -0.852 . . . . 63.3 111.384 -172.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.44 -56.23 7.12 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.763 0.425 . . . . 61.14 111.239 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -95.97 -11.55 26.37 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.267 0.84 . . . . 64.01 113.267 -168.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 55.28 71.41 0.54 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.809 0.844 . . . . 74.14 111.393 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.571 ' SD ' HD13 ' A' ' 116' ' ' LEU . 55.7 ttm -104.84 123.5 39.82 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 122.997 0.519 . . . . 71.32 110.115 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo . . . . . 0 C--N 1.365 1.396 0 C-N-CA 122.499 2.133 . . . . 75.05 112.396 175.595 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 36.2 m0 . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.373 0.13 . . . . 72.51 111.057 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.77 -19.93 60.29 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 112.51 0.559 . . . . 55.22 112.51 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -91.41 -60.68 1.83 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.868 0.867 . . . . 64.24 110.783 170.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.48 -62.68 1.52 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.785 1.234 . . . . 74.41 111.55 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.69 66.82 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.344 -1.298 . . . . 75.32 111.527 -176.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLN . . . . . 0.435 ' HA ' HD11 ' A' ' 96' ' ' ILE . 36.2 tt0 -72.34 -56.21 5.86 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.65 0.594 . . . . 72.12 111.601 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.422 ' O ' ' HB3' ' A' ' 142' ' ' ASP . 13.5 mm100 -69.22 -28.03 66.0 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.729 0.643 . . . . 74.54 111.407 -176.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -86.74 -28.46 23.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.952 -0.567 . . . . 43.54 110.593 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.629 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -72.34 -26.56 61.97 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 109.825 -0.435 . . . . 73.45 109.825 168.102 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ASP . . . . . 0.422 ' HB3' ' O ' ' A' ' 139' ' ' GLN . 25.5 t70 -62.58 -52.66 62.53 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 123.933 0.77 . . . . 53.35 108.941 172.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -60.87 -37.27 81.56 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.603 1.19 . . . . 74.14 113.138 174.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.9 t0 -76.94 -46.28 24.74 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.022 0.378 . . . . 72.21 112.022 -174.197 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.41 -36.54 84.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.492 0.717 . . . . 64.42 110.487 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -57.33 -47.21 82.17 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 115.565 -0.743 . . . . 72.42 109.507 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.35 -32.8 74.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.168 0.917 . . . . 75.22 111.889 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 1.1 t80 -65.24 -43.14 92.36 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.237 0.615 . . . . 73.51 109.854 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.07 -20.34 30.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.136 0.574 . . . . 71.44 111.645 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -79.67 -62.69 1.61 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.03 0.532 . . . . 62.5 109.933 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 92.9 mt . . . . . 0 N--CA 1.489 1.511 0 C-N-CA 126.277 1.831 . . . . 72.14 113.619 -179.691 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 111.93 0.344 . . . . 61.23 111.93 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.96 -32.52 72.96 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.949 0.499 . . . . 72.22 111.338 177.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.479 ' O ' ' HB ' ' A' ' 7' ' ' ILE . 5.9 tt -68.3 -39.64 81.99 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.391 0.676 . . . . 52.14 109.363 174.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -68.13 -29.85 68.85 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.199 0.2 . . . . 45.52 110.802 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -70.59 -34.74 72.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 119.159 -0.448 . . . . 72.01 110.416 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.479 ' HB ' ' O ' ' A' ' 4' ' ' LEU . 61.2 mt -56.26 -47.88 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.679 0.792 . . . . 61.44 110.085 169.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.2 mm -59.36 -46.93 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 115.249 -0.887 . . . . 65.23 111.16 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 13' ' ' VAL . 87.2 m -60.8 -47.46 86.23 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.876 0.871 . . . . 62.31 110.757 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -57.81 -50.62 72.67 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 123.948 0.78 . . . . 72.43 110.76 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.06 -35.05 91.5 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.602 1.189 . . . . 43.35 113.487 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -72.39 -39.71 67.79 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 122.686 0.395 . . . . 65.4 110.194 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 9' ' ' THR . 98.6 t -72.96 -26.73 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.275 0.63 . . . . 44.41 110.257 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.583 HG21 HG21 ' A' ' 35' ' ' VAL . 26.4 mt -60.13 -53.49 47.94 Favored 'Isoleucine or valine' 0 C--N 1.361 1.068 0 N-CA-C 108.897 -0.779 . . . . 70.22 108.897 171.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -57.23 -41.09 78.86 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.321 1.013 . . . . 74.12 110.94 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -53.84 -59.64 4.36 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 124.169 0.918 . . . . 74.0 112.103 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -84.13 -16.56 43.16 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 113.703 1.001 . . . . 74.22 113.703 -172.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.51 -20.55 65.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.952 0.901 . . . . 74.11 111.952 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -58.46 -19.48 37.11 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 113.269 0.84 . . . . 65.5 113.269 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -67.19 -20.2 65.68 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.804 0.668 . . . . 70.02 112.804 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.3 mmt -79.12 85.4 5.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.251 0.548 . . . . 73.11 110.752 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -75.21 -33.87 61.43 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.609 -1.256 . . . . 55.31 107.609 166.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 46.4 m-85 -92.33 162.87 14.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 114.619 -1.173 . . . . 71.23 110.37 173.29 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.9 m 54.32 65.55 1.48 Allowed 'General case' 0 C--N 1.354 0.766 0 O-C-N 124.636 1.21 . . . . 44.31 109.637 -170.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 26' ' ' LYS . 49.4 pttt -53.22 -50.07 65.48 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 114.771 -1.104 . . . . 72.22 110.524 -174.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 25' ' ' LYS . 5.5 mtpm? -80.77 -25.43 37.95 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-O 118.349 -0.834 . . . . 53.52 111.322 -172.256 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.833 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 18.1 mm-40 -70.56 -36.33 73.57 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 119.196 0.907 . . . . 74.41 109.775 175.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.0 t -67.08 -45.81 76.17 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 44.52 110.359 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.84 -33.4 66.13 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.327 -0.851 . . . . 72.53 111.238 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.677 HH22 ' HB2' ' A' ' 141' ' ' ALA . 16.6 ttm180 -69.99 -45.81 66.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.462 -0.57 . . . . 72.23 109.462 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.438 HD21 HD13 ' A' ' 76' ' ' ILE . 41.8 tp -62.89 -46.14 89.26 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 124.114 0.884 . . . . 74.14 109.696 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.52 -47.3 91.4 Favored Glycine 0 C--N 1.346 1.086 0 O-C-N 123.723 0.639 . . . . 72.22 112.614 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -60.67 -49.74 76.32 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.71 0.804 . . . . 63.43 111.12 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.534 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 17.1 mtt180 -61.66 -64.12 1.04 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.754 -1.112 . . . . 70.41 109.955 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.583 HG21 HG21 ' A' ' 14' ' ' ILE . 61.2 t -56.07 -46.73 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 124.14 0.9 . . . . 74.53 111.929 -171.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.232 0.332 . . . . 73.44 110.502 176.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.0 -20.0 74.26 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 114.307 0.483 . . . . 71.21 114.307 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 49.5 mt -87.23 -46.82 9.38 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.504 0.722 . . . . 71.05 110.792 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 12.4 pt -77.75 -38.9 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-O 118.925 -0.56 . . . . 74.11 111.482 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -56.48 -46.06 99.86 Favored Pre-proline 0 N--CA 1.487 1.386 0 N-CA-C 113.795 1.035 . . . . 72.52 113.795 -171.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -54.44 -51.67 9.98 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 121.581 1.521 . . . . 74.11 111.276 172.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.77 -31.28 72.22 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 115.452 -0.794 . . . . 72.11 111.662 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -66.44 -60.5 2.68 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.748 0.819 . . . . 75.51 110.576 178.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.2 ptp -61.11 -36.33 79.43 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 124.111 0.882 . . . . 71.43 111.455 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.606 HD13 ' SD ' ' A' ' 122' ' ' MET . 82.9 mt -67.42 -47.59 69.78 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.504 0.721 . . . . 74.42 110.305 177.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -61.57 -35.07 76.75 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.811 0.694 . . . . 74.43 111.727 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 . . . . . 0 N--CA 1.483 1.214 0 C-N-CA 123.085 0.554 . . . . 61.32 111.437 -179.809 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 81.1 p . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.89 0.376 . . . . 42.33 110.952 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.56 -33.95 76.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.127 -0.942 . . . . 73.13 110.228 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.612 ' HB3' HD22 ' A' ' 115' ' ' LEU . 35.7 mtmm -58.1 -55.18 38.26 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.589 0.756 . . . . 71.11 110.573 174.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.563 HD22 HD13 ' A' ' 115' ' ' LEU . 4.4 mm? -59.82 -49.38 77.92 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.646 0.778 . . . . 74.33 111.537 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.8 m -58.41 -50.42 73.74 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 123.931 0.769 . . . . 73.3 111.206 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.6 m -68.82 -36.51 78.31 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.319 0.648 . . . . 62.52 111.53 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -68.79 -44.24 74.0 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.645 -0.502 . . . . 63.34 109.645 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -40.33 96.66 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.987 -1.006 . . . . 64.23 111.44 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -66.83 -42.49 85.72 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.202 0.601 . . . . 73.11 111.538 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -69.15 -42.15 76.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.62 0.768 . . . . 73.25 111.027 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.413 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 20.1 t80 -71.03 -37.79 72.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.132 0.973 . . . . 73.44 110.102 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.5 ttpp -61.75 -51.19 69.37 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.289 -0.868 . . . . 73.01 109.077 174.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.66 -41.31 73.45 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.17 0.919 . . . . 75.15 111.713 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.597 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -62.27 -43.41 98.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.967 -1.015 . . . . 63.23 111.746 177.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.8 mt -75.79 -25.96 56.86 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.171 0.588 . . . . 61.24 112.214 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 52.8 mt-10 -65.74 -45.77 81.36 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.215 0.606 . . . . 74.11 109.404 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.17 -39.25 78.85 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.637 -1.165 . . . . 74.22 111.011 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.462 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -64.08 -43.37 95.62 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.5 0.5 . . . . 52.24 110.736 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.59 -46.73 88.62 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 124.547 1.154 . . . . 62.12 109.734 179.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -61.22 -42.11 99.69 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.081 -0.963 . . . . 73.34 112.446 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -59.41 -53.15 61.44 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 118.931 -0.557 . . . . 65.42 111.667 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -65.71 -28.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 N-CA-C 112.446 0.536 . . . . 71.03 112.446 178.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -64.64 -33.13 75.22 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.444 0.298 . . . . 61.32 110.687 172.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 42.2 mttm -85.5 -28.09 25.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.021 0.529 . . . . 71.45 111.012 176.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.472 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.3 m-85 -76.67 -2.84 34.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.935 0.894 . . . . 61.14 112.135 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -57.69 -25.32 60.11 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.346 0.659 . . . . 73.0 110.378 170.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -84.46 107.29 16.63 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 107.712 -1.218 . . . . 61.54 107.712 164.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -72.91 -23.65 60.73 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.469 0.708 . . . . 63.12 110.736 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.2 p -68.73 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.128 0.971 . . . . 73.21 111.335 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -61.4 -41.6 97.4 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.79 0.836 . . . . 74.21 110.236 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 97' ' ' LEU . 39.3 mt -56.89 -60.15 2.31 Favored 'Isoleucine or valine' 0 C--N 1.354 0.794 0 CA-C-N 115.109 -0.95 . . . . 74.54 109.479 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.2 t -58.27 -34.51 70.58 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 123.964 0.79 . . . . 53.0 111.631 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -59.63 -56.45 21.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.977 1.311 . . . . 73.25 110.885 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.91 -22.23 42.99 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.853 -0.158 . . . . 75.24 110.583 -177.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.2 tp -76.27 -33.96 59.12 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.58 0.752 . . . . 64.34 111.081 -172.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.3 t -68.95 -25.05 64.36 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 110.065 -0.346 . . . . 61.3 110.065 173.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.82 17.62 22.29 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.433 1.093 . . . . 61.12 111.326 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 91.3 p . . . . . 0 C--N 1.359 0.999 0 N-CA-C 109.276 -0.638 . . . . 65.31 109.276 179.617 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 108.985 -0.746 . . . . 71.25 108.985 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.833 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.0 tp -60.6 -40.67 92.65 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.694 0.759 . . . . 44.15 111.968 -171.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.421 ' HB3' ' HB ' ' A' ' 101' ' ' VAL . 5.0 m-85 -112.02 38.03 2.8 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.992 -1.004 . . . . 73.42 108.528 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -39.49 -53.53 2.05 Favored 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 113.568 0.951 . . . . 74.12 113.568 -160.085 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 34.6 t70 -80.07 -40.7 27.09 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.372 0.669 . . . . 73.42 110.74 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.421 ' HB ' ' HB3' ' A' ' 98' ' ' PHE . 56.3 t -62.91 -54.43 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.644 0.777 . . . . 62.35 111.371 -177.361 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -69.45 -26.06 64.4 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.034 0.934 . . . . 70.33 111.213 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -35.75 77.14 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.105 0.412 . . . . 73.42 110.993 164.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.9 mttm -66.01 -44.79 83.72 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.221 -0.659 . . . . 74.41 109.221 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.8 mp -53.47 -44.89 69.31 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.354 0.409 . . . . 71.23 109.972 174.001 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.42 ' HA ' ' CZ3' ' A' ' 133' ' ' TRP . 21.1 m -62.88 -57.64 10.12 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.776 0.673 . . . . 75.31 112.108 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.1 t70 -72.43 -41.71 65.87 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 114.865 -1.061 . . . . 51.14 110.692 -169.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 51.4 t -74.2 -28.79 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 115.862 -0.608 . . . . 61.12 110.882 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.409 ' CD2' HD22 ' A' ' 38' ' ' LEU . 62.5 t-105 -67.83 -37.91 82.54 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.37 0.532 . . . . 72.43 110.439 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.7 mtpt -55.12 -52.73 62.33 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.523 -0.547 . . . . 75.11 109.523 173.357 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.49 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 39.7 mt-10 -53.74 -51.73 62.39 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 124.424 1.078 . . . . 71.31 111.028 174.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -66.06 -55.24 17.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.054 0.942 . . . . 73.02 109.651 -168.464 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.2 p -59.63 -40.34 87.32 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.394 0.678 . . . . 74.41 112.0 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.7 pp -64.08 -43.01 96.71 Favored 'General case' 0 C--N 1.37 1.457 0 CA-C-N 118.139 0.427 . . . . 71.53 110.839 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.612 HD22 ' HB3' ' A' ' 57' ' ' LYS . 4.2 pp -74.6 -20.99 59.71 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.476 0.547 . . . . 53.11 112.476 177.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 43.0 mt -69.42 -36.78 77.03 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 110.041 -0.355 . . . . 75.02 110.041 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -78.02 -38.34 44.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.321 0.648 . . . . 74.24 111.419 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 49.9 t -74.57 -62.63 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.339 0.656 . . . . 63.11 111.138 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -89.8 -57.11 2.98 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 122.383 -0.198 . . . . 64.01 111.382 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -67.12 -23.19 65.79 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.638 0.586 . . . . 62.21 111.899 -172.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 56.89 32.22 21.07 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.332 1.053 . . . . 72.03 111.848 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.606 ' SD ' HD13 ' A' ' 45' ' ' LEU . 41.4 mtm -91.29 146.17 32.91 Favored Pre-proline 0 N--CA 1.467 0.422 0 N-CA-C 108.818 -0.808 . . . . 72.45 108.818 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo . . . . . 0 C--N 1.371 1.748 0 C-N-CA 123.06 2.507 . . . . 71.11 112.287 -173.91 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.42 ' CZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 111.558 0.207 . . . . 74.05 111.558 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -32.33 73.82 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.697 0.399 . . . . 74.43 111.424 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 46.7 mt-30 -84.12 -37.87 21.43 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.775 0.83 . . . . 75.34 110.838 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.85 -52.65 64.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.42 1.088 . . . . 74.43 110.73 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.69 -37.28 86.02 Favored 'General case' 0 C--O 1.239 0.506 0 O-C-N 124.665 1.228 . . . . 65.33 112.907 -174.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 1.5 pp0? -68.73 -48.68 63.18 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 109.922 -0.399 . . . . 75.24 109.922 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -63.37 -37.9 89.08 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.298 0.571 . . . . 74.13 111.441 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.13 -49.54 76.82 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.408 1.083 . . . . 55.51 109.722 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.677 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.51 -21.14 59.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.074 -0.966 . . . . 72.12 112.052 -178.703 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -64.81 -54.41 31.62 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.89 -0.781 . . . . 74.3 108.89 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.27 -39.35 92.49 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.269 0.981 . . . . 71.12 110.502 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.467 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 39.5 t0 -74.37 -48.52 27.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.661 -0.699 . . . . 70.54 112.163 -174.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 36.6 ttt-85 -65.65 -34.37 78.06 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.527 -0.546 . . . . 75.35 109.527 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -57.96 -48.68 79.25 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 123.603 0.565 . . . . 75.51 109.648 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.58 77.58 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.885 0.741 . . . . 73.23 111.8 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.9 OUTLIER -72.98 -49.18 30.56 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.612 0.57 . . . . 75.02 110.448 -178.722 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -81.55 -10.68 59.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.757 -0.656 . . . . 72.05 111.765 -172.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -96.24 -59.82 1.75 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.144 -1.058 . . . . 63.04 108.144 173.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.944 0 C-N-CA 125.957 1.703 . . . . 61.53 112.341 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 N--CA 1.476 0.851 0 N-CA-C 110.179 -0.304 . . . . 74.22 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 95.7 m-20 -58.45 -46.69 86.05 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.667 -0.697 . . . . 75.04 110.342 174.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 8' ' ' ILE . 42.6 mt -63.78 -40.49 96.8 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.863 0.727 . . . . 54.21 111.134 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -59.52 -48.42 81.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.762 -0.829 . . . . 62.51 108.762 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -66.08 -49.12 68.69 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-O 118.901 -0.571 . . . . 73.13 111.118 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.2 mt -54.42 -47.65 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.831 0.852 . . . . 62.14 111.275 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 4' ' ' LEU . 20.8 mm -66.78 -46.74 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.166 -0.925 . . . . 74.1 110.958 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -63.19 -44.0 96.59 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.536 0.522 . . . . 71.53 110.646 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.8 mt -55.49 -58.93 5.73 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.41 0.684 . . . . 72.54 109.835 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.81 -38.33 95.78 Favored Glycine 0 C--N 1.348 1.245 0 O-C-N 124.443 1.089 . . . . 61.24 114.609 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -70.98 -47.65 57.72 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 123.192 0.597 . . . . 61.05 110.259 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.44 HG12 ' HD2' ' A' ' 17' ' ' ARG . 90.6 t -64.48 -31.35 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 115.631 -0.713 . . . . 71.2 110.01 174.108 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.582 HG12 HD11 ' A' ' 76' ' ' ILE . 14.5 mt -59.02 -49.89 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.946 0.899 . . . . 35.42 109.712 174.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -60.44 -42.49 96.21 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 123.946 0.779 . . . . 74.53 111.322 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -67.11 -58.04 5.64 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.309 0.381 . . . . 73.52 111.456 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.44 ' HD2' HG12 ' A' ' 13' ' ' VAL . 1.4 ptm180 -72.07 -19.78 61.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.742 0.817 . . . . 71.42 112.992 -167.065 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 35.1 t -61.66 -16.04 45.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.919 0.888 . . . . 61.4 112.059 176.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -55.01 -12.81 0.92 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.006 1.113 . . . . 74.42 114.006 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -66.24 -18.73 65.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.381 0.673 . . . . 74.32 112.609 176.332 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 7.7 mmt -70.55 93.64 0.92 Allowed 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.081 0.467 . . . . 75.51 110.716 -175.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.569 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 11.3 mmmm -68.76 -43.93 74.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.016 0.926 . . . . 73.11 110.252 171.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -101.97 175.05 5.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.833 -1.531 . . . . 55.34 109.546 166.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.494 ' SG ' HG21 ' A' ' 85' ' ' ILE . 83.5 m 58.52 45.04 16.99 Favored 'General case' 0 C--O 1.243 0.735 0 O-C-N 124.095 0.872 . . . . 71.33 110.844 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -74.37 -45.23 48.3 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 114.627 -1.169 . . . . 72.42 110.658 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.9 mtpm? -65.07 -33.5 76.17 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.07 -0.715 . . . . 75.1 109.07 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.463 ' HB2' ' OD1' ' A' ' 144' ' ' ASP . 3.1 tp-100 -55.41 -47.02 76.56 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 123.893 0.746 . . . . 64.0 110.492 170.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 42.5 t -73.98 -21.97 59.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.201 1.0 . . . . 74.52 112.031 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -45.78 53.73 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.426 0.691 . . . . 64.45 109.739 174.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.448 ' NH2' ' HB2' ' A' ' 141' ' ' ALA . 21.9 ttp85 -75.33 -39.32 59.54 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.456 -0.793 . . . . 71.54 110.856 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.7 tp -62.86 -44.44 96.13 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.826 -0.805 . . . . 71.41 108.826 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.21 -52.67 47.98 Favored Glycine 0 C--N 1.349 1.267 0 O-C-N 124.384 1.053 . . . . 74.42 112.025 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -69.45 -34.12 73.93 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.092 0.557 . . . . 54.33 112.424 -177.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.656 HH12 ' HB2' ' A' ' 106' ' ' SER . 14.4 mtt180 -65.45 -58.81 4.92 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.092 -0.707 . . . . 61.3 109.092 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 39' ' ' ILE . 53.3 t -55.89 -44.81 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 124.435 1.084 . . . . 72.14 111.279 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.476 HD23 HD11 ' A' ' 39' ' ' ILE . 75.6 mt -62.14 -38.83 90.46 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.643 0.589 . . . . 63.45 110.666 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -71.89 -20.5 78.83 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.803 -0.443 . . . . 73.34 113.563 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 60.8 mt -85.71 -45.98 11.14 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.044 0.537 . . . . 60.45 111.137 177.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.476 HD11 HD23 ' A' ' 36' ' ' LEU . 14.3 pt -78.34 -43.22 26.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 118.869 -0.586 . . . . 71.44 110.904 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -52.4 -53.65 50.83 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 114.37 1.248 . . . . 72.22 114.37 -173.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.35 -32.64 81.37 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.768 1.645 . . . . 72.01 112.459 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 46' ' ' GLN . 4.3 mm? -75.16 -37.01 61.48 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.757 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HG3' HD12 ' A' ' 8' ' ' ILE . 78.6 mt-10 -67.06 -40.5 87.09 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.585 1.154 . . . . 75.42 111.25 -177.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.0 mmt -60.67 -40.28 91.52 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.984 0.803 . . . . 75.11 110.542 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.9 mt -80.7 -26.33 37.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.615 0.766 . . . . 75.35 111.481 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -74.76 -29.22 61.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.106 0.962 . . . . 63.23 109.942 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.306 0.642 . . . . 75.11 110.899 175.75 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 43.6 t . . . . . 0 C--O 1.242 0.682 0 N-CA-C 109.806 -0.442 . . . . 72.42 109.806 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.41 -27.85 65.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.69 -0.687 . . . . 44.14 110.602 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -74.2 -30.54 62.25 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.859 0.464 . . . . 71.24 111.028 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HG ' ' HB3' ' A' ' 55' ' ' SER . 59.1 mt -69.46 -41.77 75.78 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.437 0.461 . . . . 65.34 109.978 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.4 m -61.14 -49.0 79.04 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 124.181 0.925 . . . . 70.1 109.933 175.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 79.9 m -60.98 -40.43 93.43 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.75 0.656 . . . . 74.52 111.24 178.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -62.29 -50.11 72.97 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.684 0.794 . . . . 74.25 110.854 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.6 mmt -72.63 -19.38 61.46 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 115.271 -0.877 . . . . 70.31 112.34 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -78.22 -44.12 26.51 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 122.916 0.486 . . . . 61.43 110.248 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -60.6 -46.18 91.2 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.191 0.996 . . . . 74.11 109.914 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.9 t80 -65.83 -50.92 62.89 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 114.569 -1.196 . . . . 53.02 109.444 -176.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.495 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 ttpm? -54.45 -46.57 73.31 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.455 0.702 . . . . 71.41 111.065 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.99 -43.71 94.99 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 124.038 0.836 . . . . 74.22 111.17 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.57 -39.2 88.36 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.632 -0.713 . . . . 64.11 111.546 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -65.64 -34.15 77.55 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.22 1.008 . . . . 71.01 111.299 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 80.9 mm-40 -61.06 -49.7 76.29 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.313 0.645 . . . . 64.33 109.283 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 33.7 mt-10 -59.32 -44.19 92.61 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.291 -1.322 . . . . 74.33 111.032 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.55 -42.98 99.88 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 123.914 0.759 . . . . 74.55 111.34 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -61.47 -36.42 80.39 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.812 0.695 . . . . 72.52 110.101 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -70.2 -36.72 71.43 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 114.83 -1.077 . . . . 65.44 112.328 177.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 11.5 mm-40 -62.63 -51.43 67.31 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 122.881 0.472 . . . . 52.45 109.774 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.582 HD11 HG12 ' A' ' 14' ' ' ILE . 2.3 pt -74.63 -19.39 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 112.566 0.58 . . . . 73.0 112.566 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.79 -40.63 93.35 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.606 -0.516 . . . . 71.3 109.606 167.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 77.1 mttt -74.77 -45.42 43.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.498 0.719 . . . . 65.11 110.616 175.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.56 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.5 m-30 -73.32 -4.28 32.32 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.116 0.966 . . . . 65.14 112.542 -173.059 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.9 p -57.33 -32.12 66.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.083 0.553 . . . . 72.54 110.234 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -84.43 118.8 24.49 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.149 -0.932 . . . . 72.44 109.265 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.569 ' HG2' ' HB2' ' A' ' 22' ' ' LYS . 4.1 mpt_? -74.14 -31.72 62.86 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.429 1.092 . . . . 74.45 110.046 -176.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.7 m -64.93 -36.05 83.14 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.813 -1.085 . . . . 74.31 111.04 174.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.4 -40.7 97.92 Favored 'General case' 0 C--O 1.252 1.185 0 C-N-CA 123.436 0.695 . . . . 74.42 110.532 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 97' ' ' LEU . 21.8 mt -58.91 -55.48 23.08 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 O-C-N 124.133 0.895 . . . . 75.21 109.536 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.7 t -56.22 -40.03 73.41 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.862 0.726 . . . . 65.14 111.911 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.8 -46.09 91.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.92 0.888 . . . . 55.13 111.452 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.28 -22.96 30.54 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 119.552 -0.261 . . . . 73.22 110.648 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 tp -73.3 -36.57 66.3 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.85 0.86 . . . . 75.31 110.662 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -74.65 -14.49 60.76 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.119 -0.946 . . . . 64.22 110.28 175.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -108.82 11.15 26.4 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.541 1.136 . . . . 73.42 110.163 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.7 t . . . . . 0 C--N 1.354 0.787 0 C-N-CA 124.035 0.934 . . . . 32.43 108.932 177.769 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 96' ' ' ILE . 2.7 mp . . . . . 0 CA--C 1.539 0.53 0 N-CA-C 109.133 -0.692 . . . . 74.51 109.133 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.537 HD11 HG23 ' A' ' 85' ' ' ILE . 12.0 tp -60.68 -30.87 70.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.968 1.307 . . . . 72.01 111.875 -175.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -111.65 13.06 21.21 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.679 -1.153 . . . . 74.11 111.423 -175.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -37.15 -57.86 0.84 Allowed 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 114.512 1.301 . . . . 73.23 114.512 -159.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.476 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 16.3 t70 -54.84 -62.44 1.66 Allowed 'General case' 0 N--CA 1.479 0.983 0 O-C-N 124.432 1.083 . . . . 74.43 110.749 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.03 -49.04 85.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 CA-C-N 114.903 -1.044 . . . . 73.55 111.676 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.7 -28.62 67.01 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.344 0.658 . . . . 65.53 111.331 -175.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -69.65 -34.17 73.64 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.366 -0.605 . . . . 74.13 109.366 172.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.1 mtpt -66.74 -42.64 85.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 119.148 -0.453 . . . . 71.31 110.873 174.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.519 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -59.83 -40.11 87.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 109.762 -0.458 . . . . 75.54 109.762 171.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.656 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.6 t -66.86 -42.53 85.52 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.765 0.666 . . . . 61.33 111.758 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -70.14 -47.63 60.88 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.659 0.783 . . . . 73.4 109.856 -177.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 45.6 t -72.88 -21.7 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.171 -0.922 . . . . 75.24 110.873 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.417 ' HA ' ' HB2' ' A' ' 112' ' ' LEU . 42.5 t-105 -78.54 -35.24 46.44 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 118.469 0.577 . . . . 74.24 110.855 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -57.71 -52.52 65.1 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.616 -0.883 . . . . 70.41 108.616 172.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.488 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 49.7 mt-10 -57.69 -49.3 76.95 Favored 'General case' 0 C--N 1.351 0.631 0 CA-C-N 114.359 -1.291 . . . . 65.2 110.261 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.5 OUTLIER -54.75 -60.5 3.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.512 1.132 . . . . 75.51 109.444 -174.503 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 84.4 p -59.18 -37.19 76.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.269 -0.878 . . . . 64.42 111.501 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.5 -57.29 8.6 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 111.922 0.341 . . . . 72.35 111.922 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 3.6 pp -66.28 -35.28 79.99 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-N 117.982 0.355 . . . . 72.52 111.6 -175.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.546 HD22 ' SD ' ' A' ' 122' ' ' MET . 94.1 mt -67.82 -50.94 53.96 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 123.183 0.593 . . . . 74.4 110.57 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.16 -45.71 69.36 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.118 0.485 . . . . 51.33 112.062 -173.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 94.0 t -84.76 -42.41 16.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-N 115.378 -0.828 . . . . 75.0 111.39 -171.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.5 -57.75 2.31 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 109.47 -0.567 . . . . 41.31 109.47 -175.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -11.85 59.89 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 123.521 0.729 . . . . 72.32 111.308 -174.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 65.57 44.15 3.11 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 125.259 1.424 . . . . 60.52 112.017 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.546 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.5 mtp -110.5 112.63 56.56 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.49 1.116 . . . . 64.3 109.8 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo . . . . . 0 C--N 1.372 1.763 0 C-N-CA 122.887 2.391 . . . . 71.32 112.061 -177.807 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.513 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 5.8 t90 . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 111.344 0.127 . . . . 73.42 111.344 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.22 -39.84 20.41 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.736 0.814 . . . . 63.55 111.491 173.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -67.74 -34.31 76.58 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.857 0.863 . . . . 62.33 111.518 -173.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.72 -35.08 70.19 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.47 -1.241 . . . . 74.51 111.024 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.66 -43.45 89.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.157 0.583 . . . . 73.5 111.557 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.47 -59.81 4.3 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.941 0.776 . . . . 74.14 110.259 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.41 -54.18 48.64 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.197 0.936 . . . . 64.53 111.846 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.41 -49.86 75.18 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.195 0.934 . . . . 73.33 110.857 -173.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.448 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . . . -66.71 -31.28 71.84 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 124.159 0.912 . . . . 71.15 111.432 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.27 -52.66 62.81 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 123.636 0.585 . . . . 73.4 110.12 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.27 -36.08 77.0 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.263 0.977 . . . . 71.4 111.458 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.9 t70 -75.73 -50.21 15.98 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.371 1.068 . . . . 72.12 112.045 -172.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -66.03 -33.34 75.59 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.148 -0.686 . . . . 75.22 109.148 175.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -67.35 -32.23 73.03 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.048 0.539 . . . . 62.22 109.988 174.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.59 -21.86 60.2 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.244 0.618 . . . . 64.32 111.335 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -54.91 12.12 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.394 -0.595 . . . . 74.22 109.394 169.303 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.56 -47.52 85.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.386 0.674 . . . . 70.31 111.565 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 40.6 ttm -84.76 -72.74 0.46 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.599 0.76 . . . . 43.34 109.441 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 35.5 tp . . . . . 0 CA--C 1.551 0.988 0 C-N-CA 125.347 1.459 . . . . 53.02 112.331 -178.02 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 110.605 -0.146 . . . . 72.34 110.605 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.636 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 16.4 m120 -59.15 -59.7 5.04 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 123.891 0.745 . . . . 65.11 109.934 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.486 ' O ' HG12 ' A' ' 8' ' ' ILE . 56.8 mt -61.91 -39.53 92.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 124.29 0.994 . . . . 72.22 112.165 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.28 -48.06 81.66 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.431 0.692 . . . . 60.41 109.91 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -72.38 -41.57 66.2 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-O 118.766 -0.635 . . . . 55.43 111.528 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.6 mt -52.56 -49.26 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.648 0.779 . . . . 74.42 110.673 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 4' ' ' LEU . 28.6 mm -71.69 -41.53 71.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 114.685 -1.143 . . . . 63.53 111.202 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -61.51 -59.12 5.72 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 122.893 0.477 . . . . 73.33 110.053 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.411 ' O ' HG13 ' A' ' 14' ' ' ILE . 27.2 mt -52.06 -49.4 63.55 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.309 1.044 . . . . 64.04 111.517 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.49 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -64.08 -39.05 96.83 Favored Glycine 0 C--N 1.351 1.383 0 O-C-N 123.955 0.785 . . . . 44.41 114.081 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -69.47 -44.26 71.55 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 109.284 -0.636 . . . . 72.52 109.284 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.467 HG12 ' HD2' ' A' ' 17' ' ' ARG . 69.5 t -61.88 -31.35 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.2 1.0 . . . . 74.21 111.013 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.507 HG21 HG21 ' A' ' 35' ' ' VAL . 68.3 mt -61.03 -53.26 51.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 109.047 -0.723 . . . . 70.34 109.047 172.234 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -58.33 -30.61 66.84 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 123.884 0.74 . . . . 72.4 112.142 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -76.45 -51.44 11.78 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.893 0.477 . . . . 73.32 111.672 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.467 ' HD2' HG12 ' A' ' 13' ' ' VAL . 9.7 ptm180 -84.47 -19.53 33.21 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.977 0.511 . . . . 74.14 112.235 -169.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.521 ' SG ' HD23 ' A' ' 31' ' ' LEU . 21.8 t -71.17 -19.84 62.36 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.499 0.72 . . . . 74.04 110.413 177.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -63.88 -13.17 42.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.284 0.634 . . . . 74.52 111.675 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -28.54 70.14 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.491 0.717 . . . . 65.22 110.247 174.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.6 mmt -70.31 89.24 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.126 0.571 . . . . 74.01 110.138 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -77.81 -24.01 48.9 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.299 -1.0 . . . . 64.12 108.299 170.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.536 ' HD1' ' HG2' ' A' ' 82' ' ' ARG . 83.8 m-85 -104.23 171.79 7.15 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.624 1.17 . . . . 74.33 109.461 167.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.649 ' SG ' HG21 ' A' ' 85' ' ' ILE . 57.9 m 53.01 49.92 19.1 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 124.093 0.87 . . . . 61.5 110.936 -175.508 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 51.1 pttt -61.5 -49.68 75.78 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 113.726 -1.579 . . . . 72.12 111.904 -174.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.574 ' HB3' ' HB2' ' A' ' 140' ' ' ASP . 28.6 mmtp -67.31 -45.26 77.05 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.544 0.337 . . . . 71.03 111.648 -174.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.82 -33.14 75.16 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.114 0.565 . . . . 74.4 110.999 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 21.5 t -75.72 -38.51 58.5 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.938 0.895 . . . . 72.41 111.849 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 25' ' ' LYS . 50.9 mtp85 -66.86 -41.8 86.75 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.798 -0.445 . . . . 73.14 109.798 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 32.3 ttp85 -63.04 -47.83 81.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.32 -0.854 . . . . 72.31 110.84 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.521 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.2 tp -55.08 -57.73 10.52 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.677 0.61 . . . . 70.22 110.776 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -42.95 98.46 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.061 0.85 . . . . 71.33 113.571 -177.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -60.02 -46.39 89.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.314 0.646 . . . . 65.25 111.514 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.515 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 70.2 mtt-85 -61.55 -53.83 51.16 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.837 0.71 . . . . 75.42 110.333 178.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.507 HG21 HG21 ' A' ' 14' ' ' ILE . 77.1 t -53.62 -43.54 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 124.168 0.918 . . . . 71.45 111.415 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 39' ' ' ILE . 72.5 mt -63.4 -46.16 87.69 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 123.695 0.622 . . . . 63.41 111.147 177.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.94 -22.81 65.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.084 -0.507 . . . . 52.32 113.31 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.573 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 36.6 mt -87.0 -42.55 13.02 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.452 0.701 . . . . 64.2 112.546 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 36' ' ' LEU . 18.7 pt -80.94 -40.14 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 112.096 0.406 . . . . 73.44 112.096 -172.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -57.55 -44.04 99.29 Favored Pre-proline 0 N--CA 1.486 1.374 0 N-CA-C 114.257 1.206 . . . . 70.35 114.257 -173.337 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.94 -31.84 83.32 Favored 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 122.325 2.016 . . . . 60.11 112.609 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.447 HD13 HD21 ' A' ' 45' ' ' LEU . 3.3 mm? -83.25 -29.87 28.1 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.044 -0.526 . . . . 73.44 110.383 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.54 -31.84 72.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.985 0.514 . . . . 62.43 110.837 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.5 mtm -65.89 -45.84 80.55 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 123.423 0.452 . . . . 63.04 111.556 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 HD13 ' A' ' 42' ' ' LEU . 4.3 pp -76.35 -26.97 56.27 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.277 0.231 . . . . 73.12 111.167 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -64.3 -42.49 96.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.121 0.969 . . . . 72.13 109.704 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 N--CA 1.475 0.824 0 CA-C-N 114.475 -1.239 . . . . 45.43 110.599 175.603 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 CA--C 1.55 0.943 0 N-CA-C 110.0 -0.37 . . . . 64.44 110.0 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -54.22 -56.9 13.76 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.389 0.676 . . . . 72.32 110.147 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE3' ' HG3' ' A' ' 119' ' ' GLU . 47.0 pttt -68.77 -31.24 70.13 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.278 -0.874 . . . . 64.34 112.639 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.442 HD22 HD13 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -65.88 -55.74 15.44 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 108.702 -0.851 . . . . 71.23 108.702 -178.124 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 m -67.5 -36.05 80.33 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.2 -0.909 . . . . 74.43 111.372 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 100.0 m -62.31 -45.99 90.74 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 123.266 0.354 . . . . 62.44 110.962 177.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.78 94.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 123.571 0.544 . . . . 63.01 110.459 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.636 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 24.8 mmt -68.38 -25.97 65.33 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-N 115.588 -0.733 . . . . 63.22 112.252 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -75.7 -45.65 35.63 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.788 0.835 . . . . 73.42 110.269 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -62.88 -42.42 99.76 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.261 1.025 . . . . 61.21 110.245 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.573 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 6.3 t80 -67.03 -52.57 40.79 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 114.903 -1.044 . . . . 74.14 109.297 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.61 -47.12 63.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.41 1.084 . . . . 73.43 110.635 177.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.3 90.77 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.982 0.801 . . . . 42.04 111.486 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -65.19 -38.37 90.27 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.832 0.853 . . . . 65.11 111.512 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -63.37 -35.16 79.47 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.829 0.852 . . . . 71.12 111.046 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -68.69 -38.78 80.59 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.86 0.464 . . . . 74.22 111.171 175.043 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -59.24 -49.32 78.29 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 123.478 0.486 . . . . 74.14 109.954 176.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.74 -52.16 66.66 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.222 0.951 . . . . 41.42 111.634 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.44 -45.61 80.7 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.582 1.153 . . . . 73.12 111.758 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.38 -38.83 91.49 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.81 -1.086 . . . . 52.31 112.874 -176.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -76.84 -37.26 55.97 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.221 -0.895 . . . . 62.12 112.183 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -65.38 -32.53 58.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.492 1.042 . . . . 64.44 110.505 171.297 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.66 -47.5 84.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.323 -0.621 . . . . 63.4 109.323 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -71.6 -27.94 63.47 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.085 0.554 . . . . 44.11 112.248 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.77 4.51 36.58 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.743 0.817 . . . . 74.32 111.886 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.7 p -58.96 -26.44 64.43 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.019 0.438 . . . . 51.43 111.201 175.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -79.23 108.15 12.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.274 -1.01 . . . . 75.44 108.274 165.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.536 ' HG2' ' HD1' ' A' ' 23' ' ' TYR . 2.3 mpt_? -71.34 -24.08 62.04 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.28 0.632 . . . . 75.03 109.924 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.9 m -67.43 -35.74 79.85 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.724 0.81 . . . . 60.04 111.246 172.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.85 -41.0 99.18 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.051 0.94 . . . . 73.14 110.067 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 24' ' ' CYS . 46.8 mt -59.73 -59.08 4.49 Favored 'Isoleucine or valine' 0 C--N 1.352 0.715 0 CA-C-N 114.754 -1.112 . . . . 75.23 109.671 175.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.46 -33.48 65.95 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.176 0.59 . . . . 74.41 111.999 -178.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -60.04 -53.66 55.23 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.36 1.064 . . . . 70.14 111.258 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -77.96 -26.79 48.99 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 122.306 -0.246 . . . . 70.34 110.458 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.537 ' HG ' ' HG2' ' A' ' 145' ' ' ARG . 10.5 tp -72.7 -36.51 67.86 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.811 0.844 . . . . 75.33 110.951 -169.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.7 t -67.53 -30.67 70.38 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.664 -0.698 . . . . 74.54 110.605 175.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.25 -3.48 57.78 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.142 0.977 . . . . 51.12 110.936 177.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.473 0.702 0 C-N-CA 124.095 0.958 . . . . 63.44 110.485 177.88 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 22.2 mm . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 108.464 -0.939 . . . . 73.42 108.464 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -36.99 -54.17 0.95 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 125.714 1.606 . . . . 61.1 112.232 -178.503 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 52.9 m-85 -128.49 42.37 3.33 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 114.97 -1.014 . . . . 74.25 112.006 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.566 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 4.9 tmtm? -58.58 -61.1 2.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 119.512 1.051 . . . . 71.24 109.916 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.83 -41.03 92.29 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.287 -0.869 . . . . 54.34 111.626 -174.349 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.7 t -67.86 -43.63 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 123.513 0.508 . . . . 72.3 110.851 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.427 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 19.4 t30 -61.41 -38.88 88.72 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.563 -0.744 . . . . 74.51 110.269 174.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -31.89 72.8 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.033 0.533 . . . . 72.44 109.801 177.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.81 -56.68 10.63 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.154 0.582 . . . . 74.42 109.878 174.232 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.8 mp -55.3 -38.87 69.22 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.688 0.618 . . . . 40.3 111.008 178.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.2 t -73.66 -49.07 27.75 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.527 0.731 . . . . 73.52 111.888 -174.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.41 -48.59 74.83 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.44 0.696 . . . . 74.02 109.674 -177.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.1 t -64.52 -37.12 79.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 CA-C-N 114.968 -1.015 . . . . 74.52 110.516 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.42 ' HZ3' HD21 ' A' ' 42' ' ' LEU . 61.2 t-105 -60.97 -38.65 86.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.56 0.344 . . . . 75.44 111.497 176.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.0 -56.9 16.3 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.118 -0.697 . . . . 74.4 109.118 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -55.27 -44.69 75.84 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.199 0.937 . . . . 70.32 111.16 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.427 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.4 tt -69.82 -53.4 18.38 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.29 1.436 . . . . 74.43 110.796 -171.36 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.5 t -63.64 -36.02 82.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.371 0.668 . . . . 65.4 110.998 -179.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.54 -53.54 54.96 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.563 0.539 . . . . 70.4 111.155 176.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.442 HD13 HD22 ' A' ' 58' ' ' LEU . 3.9 pp -70.05 -24.42 63.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.089 -0.382 . . . . 71.12 111.796 -177.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.17 -43.14 71.45 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.297 0.239 . . . . 62.24 111.149 173.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.54 -23.06 40.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.509 0.559 . . . . 70.03 112.509 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.96 -50.13 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.407 0.283 . . . . 53.32 111.203 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.454 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 24.8 mm-40 -81.34 -56.76 3.84 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.924 0.392 . . . . 74.21 110.883 -176.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -86.72 -1.36 57.66 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 115.647 -0.706 . . . . 74.12 110.83 -175.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.7 mmt180 65.52 19.01 11.46 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.173 1.389 . . . . 73.14 113.331 170.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 50.9 mtp -70.64 143.05 89.37 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.708 0.803 . . . . 71.53 112.01 -173.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo . . . . . 0 C--N 1.37 1.676 0 C-N-CA 122.464 2.109 . . . . 74.52 113.194 179.558 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.8 m0 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 113.307 0.854 . . . . 73.23 113.307 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.91 -41.35 19.01 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.149 0.5 . . . . 45.52 110.69 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -80.78 -23.76 39.08 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.134 0.79 . . . . 61.14 113.134 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.43 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 76.8 mt-10 -62.29 -53.69 51.47 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.477 0.486 . . . . 73.5 109.732 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.97 -61.82 1.86 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.95 1.406 . . . . 75.32 111.563 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -60.54 -41.04 93.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 123.529 0.518 . . . . 54.13 112.304 -179.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 34.1 tt0 -67.87 -63.29 1.09 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 118.035 0.379 . . . . 61.32 111.746 -175.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 2.6 p30 -73.4 -30.58 63.36 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.276 -0.392 . . . . 72.21 111.623 -171.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.55 -23.06 50.18 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-O 119.117 -0.468 . . . . 55.4 111.453 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -60.51 -51.95 67.27 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.588 -0.893 . . . . 64.0 108.588 164.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 36.9 mt-10 -59.44 -40.47 86.9 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 124.085 0.865 . . . . 53.04 111.528 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 14.2 t0 -79.75 -45.97 17.87 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.16 0.984 . . . . 72.01 110.962 -168.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.537 ' HG2' ' HG ' ' A' ' 89' ' ' LEU . 4.3 tmt_? -62.73 -42.98 99.93 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.191 0.997 . . . . 55.51 109.158 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -67.45 -34.24 76.79 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.626 -0.716 . . . . 74.51 111.027 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.25 -24.9 54.55 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.525 0.33 . . . . 53.22 111.847 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.06 -36.75 35.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.845 0.458 . . . . 64.25 110.043 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -80.51 -41.18 24.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.092 0.557 . . . . 73.22 112.042 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.4 tpt -102.54 55.97 0.78 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 107.076 -1.453 . . . . 65.13 107.076 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.422 HD21 ' HE2' ' A' ' 23' ' ' TYR . 42.3 tp . . . . . 0 N--CA 1.469 0.513 0 CA-C-N 114.052 -1.431 . . . . 71.51 111.156 -168.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 110.238 -0.282 . . . . 74.34 110.238 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -59.09 -51.51 69.73 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.789 -0.449 . . . . 73.03 109.789 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.61 -36.7 81.49 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 124.063 0.852 . . . . 65.52 111.375 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -57.53 -47.63 81.48 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 123.532 0.52 . . . . 71.34 109.784 176.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.98 -47.99 78.21 Favored 'General case' 0 C--O 1.212 -0.915 0 O-C-N 123.886 0.741 . . . . 74.31 110.977 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.13 -49.37 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 123.999 0.92 . . . . 73.33 111.313 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.3 mm -71.31 -43.81 73.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 CA-C-N 115.141 -0.936 . . . . 70.32 111.049 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -62.49 -51.19 68.43 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 122.874 0.469 . . . . 70.14 109.987 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -54.33 -46.48 72.89 Favored 'General case' 0 C--O 1.208 -1.116 0 O-C-N 124.453 1.095 . . . . 75.33 110.548 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.44 -52.95 49.77 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 124.332 1.02 . . . . 64.23 113.828 -177.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.41 ' HG3' HD12 ' A' ' 39' ' ' ILE . 27.3 mt-30 -66.25 -40.72 90.4 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 122.842 0.457 . . . . 65.22 111.2 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.44 -37.75 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.885 0.874 . . . . 73.11 110.427 174.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.516 HD11 ' O ' ' A' ' 69' ' ' LEU . 17.0 mt -59.24 -50.8 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.663 1.185 . . . . 71.53 109.804 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -56.97 -43.86 82.04 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.354 1.034 . . . . 75.2 111.286 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.69 -49.41 71.01 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.033 0.533 . . . . 73.04 112.141 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.536 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 10.4 ptm180 -81.8 -16.44 50.92 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.495 0.554 . . . . 64.11 112.495 -174.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 38.5 t -69.03 -19.84 64.12 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.515 0.726 . . . . 75.15 110.775 173.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.13 1.93 6.66 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.48 0.712 . . . . 74.34 112.154 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -65.95 -32.1 73.39 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.246 0.618 . . . . 61.52 111.064 165.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.46 ' SD ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -71.4 86.04 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.824 0.449 . . . . 63.52 110.897 -176.837 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -71.31 -47.4 56.93 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 106.7 -1.593 . . . . 72.33 106.7 170.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.438 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.8 m-85 -91.53 142.98 27.06 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.358 -1.349 . . . . 71.41 107.358 164.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.531 ' SG ' HG21 ' A' ' 85' ' ' ILE . 38.9 m 63.34 46.05 4.63 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 124.248 0.967 . . . . 75.01 110.247 -160.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 28' ' ' CYS . 56.9 pttt -70.07 -44.29 69.42 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.78 -1.555 . . . . 74.3 111.511 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.721 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 45.1 mtpt -74.22 -26.87 60.5 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 119.178 -0.439 . . . . 74.23 109.83 -178.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -31.22 71.83 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.649 0.593 . . . . 71.44 109.969 171.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.652 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 9.0 t -67.18 -43.63 81.72 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.638 0.775 . . . . 62.44 111.432 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -76.39 -24.84 54.09 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-O 119.84 -0.124 . . . . 73.53 111.027 176.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 4.1 tpm_? -65.09 -59.08 4.52 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.547 -0.909 . . . . 74.34 108.547 176.042 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 ' SG ' ' A' ' 18' ' ' CYS . 58.3 tp -61.5 -47.42 85.72 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 124.731 1.27 . . . . 51.21 110.615 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.59 -54.74 34.59 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 124.076 0.86 . . . . 54.12 113.67 -174.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -67.01 -32.51 73.79 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.323 0.649 . . . . 73.25 110.617 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 30' ' ' ARG . 1.7 mtt-85 -56.3 -56.93 14.97 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 123.858 0.724 . . . . 73.32 110.645 173.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 31' ' ' LEU . 65.2 t -60.97 -43.22 95.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 CA-C-N 114.156 -1.384 . . . . 74.2 110.559 -175.077 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.47 -50.42 74.01 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.865 0.466 . . . . 55.23 110.939 177.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.34 -18.63 69.71 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 115.379 -0.828 . . . . 73.44 113.557 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.9 -52.56 5.92 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.771 0.828 . . . . 74.15 110.259 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.41 HD12 ' HG3' ' A' ' 12' ' ' GLN . 16.2 pt -75.89 -32.84 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 118.761 -0.638 . . . . 74.2 111.977 -167.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 44' ' ' MET . 92.7 mttt -58.15 -49.56 92.91 Favored Pre-proline 0 CA--C 1.561 1.401 0 CA-C-O 117.609 -1.186 . . . . 72.14 112.506 -178.199 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -45.65 -43.37 18.53 Favored 'Trans proline' 0 C--N 1.401 3.306 0 C-N-CA 122.932 2.421 . . . . 72.4 113.485 169.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -71.05 -38.72 72.53 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.653 0.381 . . . . 52.3 111.19 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 47.7 mt-10 -67.42 -20.89 65.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.794 0.438 . . . . 75.13 111.085 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 28.3 mmt -68.55 -55.8 10.46 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 110.008 -0.367 . . . . 70.44 110.008 173.272 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.682 HD23 ' SD ' ' A' ' 122' ' ' MET . 2.6 pp -70.25 -21.49 62.98 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 111.623 0.231 . . . . 64.4 111.623 179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.3 tm0? -80.44 -33.33 36.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.014 0.926 . . . . 44.52 110.35 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 109.597 -0.52 . . . . 72.01 109.597 178.212 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.4 p . . . . . 0 N--CA 1.477 0.886 0 CA-C-O 119.039 -0.505 . . . . 60.11 109.833 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -52.8 -46.53 67.69 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.439 0.696 . . . . 74.01 112.549 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -64.07 -39.49 94.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.737 0.815 . . . . 61.21 111.568 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.97 -35.55 64.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.11 0.964 . . . . 74.22 110.423 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 m -66.54 -49.69 65.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.942 0.897 . . . . 54.14 109.077 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.436 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 32.3 m -61.04 -38.31 85.69 Favored 'General case' 0 C--N 1.356 0.862 0 O-C-N 124.06 0.85 . . . . 73.01 110.482 178.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.485 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.4 -45.65 83.15 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 123.565 0.746 . . . . 72.33 110.611 -179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.3 mmt -70.17 -24.96 63.23 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 123.821 0.701 . . . . 73.11 111.666 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -71.79 -46.23 58.98 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.218 0.607 . . . . 73.3 110.173 174.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.3 mtt180 -62.44 -38.25 89.02 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.753 0.821 . . . . 73.11 110.311 175.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.1 t80 -63.32 -59.71 4.35 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 113.704 -1.589 . . . . 74.42 109.192 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 25.2 ttpp -56.17 -44.12 79.04 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 124.561 1.163 . . . . 62.34 110.697 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.28 82.65 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 124.258 0.974 . . . . 62.32 112.142 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -68.86 -39.19 79.99 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.511 0.725 . . . . 52.31 111.418 178.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.516 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -68.53 -31.18 70.24 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.713 0.805 . . . . 73.41 111.131 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 55.3 mt-10 -67.44 -43.42 81.19 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.646 -0.501 . . . . 61.51 109.646 174.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.72 -38.97 92.81 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.127 -0.942 . . . . 75.25 111.06 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.13 -44.96 86.97 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.413 0.685 . . . . 52.03 110.578 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -59.8 -41.6 91.56 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 124.328 1.017 . . . . 63.01 110.658 176.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.87 -37.09 91.99 Favored Glycine 0 C--N 1.35 1.307 0 CA-C-N 115.438 -0.801 . . . . 73.1 113.107 177.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.58 -52.2 62.04 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 122.832 0.453 . . . . 75.4 110.458 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.445 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -70.61 -20.0 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 N-CA-C 112.616 0.598 . . . . 74.54 112.616 178.982 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.536 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 3.3 tm-20 -67.32 -43.37 81.8 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.344 -0.613 . . . . 74.35 109.344 170.087 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -69.38 -40.87 77.17 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.973 0.909 . . . . 73.43 111.416 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 13.9 m-85 -80.8 0.34 35.28 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.078 0.951 . . . . 74.41 112.511 -173.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -56.43 -32.29 64.76 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.368 0.604 . . . . 71.12 109.859 174.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -82.62 112.23 19.31 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 114.858 -1.065 . . . . 70.11 109.441 168.466 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -74.9 -24.35 58.52 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.775 0.83 . . . . 73.03 110.566 -177.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -67.48 -37.55 83.05 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.078 0.951 . . . . 63.23 111.076 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.55 -46.22 89.51 Favored 'General case' 0 C--O 1.255 1.37 0 C-N-CA 124.098 0.959 . . . . 71.0 110.076 173.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 97' ' ' LEU . 34.2 mt -58.31 -56.29 17.08 Favored 'Isoleucine or valine' 0 C--N 1.358 0.942 0 CA-C-N 114.573 -1.194 . . . . 61.34 109.956 177.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.3 t -53.91 -39.92 66.24 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.675 1.19 . . . . 33.43 111.612 -176.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -61.04 -54.1 48.94 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 124.544 1.153 . . . . 75.05 111.026 179.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -22.86 53.42 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 116.306 -0.407 . . . . 71.42 111.051 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.1 tp -80.75 -33.77 34.82 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.099 0.96 . . . . 65.13 110.888 -172.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.7 t -72.75 -20.22 61.23 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 121.125 0.488 . . . . 54.11 109.992 172.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.34 8.9 43.67 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.48 1.112 . . . . 43.34 111.244 174.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.484 1.269 0 C-N-CA 124.612 1.165 . . . . 61.4 109.466 -178.959 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 9.1 mm . . . . . 0 CA--C 1.547 0.828 0 N-CA-C 108.217 -1.031 . . . . 75.32 108.217 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.644 HD11 HG23 ' A' ' 85' ' ' ILE . 4.5 tp -58.13 -30.51 66.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.928 0.714 . . . . 72.04 112.928 -168.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -119.63 17.88 12.76 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-O 118.159 -0.924 . . . . 70.2 110.645 -176.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -36.3 -53.32 0.83 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 115.024 1.491 . . . . 73.5 115.024 -160.958 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ASP . . . . . 0.46 ' N ' ' HD3' ' A' ' 99' ' ' LYS . 30.6 m-20 -71.3 -50.75 29.34 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 118.648 0.658 . . . . 73.14 111.564 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.92 -52.82 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 123.944 0.898 . . . . 54.21 111.18 -176.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -63.78 -36.88 85.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.334 1.054 . . . . 75.34 110.998 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -62.71 -32.26 73.33 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.197 0.599 . . . . 64.14 110.717 172.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 98.9 mttt -70.99 -39.74 72.27 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 119.348 -0.358 . . . . 55.41 110.214 174.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.2 -44.61 88.18 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.603 -0.517 . . . . 73.54 109.603 172.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.4 m -63.11 -50.42 70.57 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.015 0.926 . . . . 60.53 111.347 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 37.6 t70 -73.56 -44.05 58.35 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 115.128 -0.942 . . . . 74.44 111.184 -171.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 93.8 t -64.06 -36.48 77.0 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 118.843 -0.598 . . . . 72.42 109.416 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -64.21 -44.71 91.08 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 119.088 -0.482 . . . . 74.14 112.055 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -64.78 -44.31 90.42 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 118.568 0.622 . . . . 51.12 110.378 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 11.9 mm-40 -60.8 -41.04 94.86 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.044 0.449 . . . . 61.11 111.076 176.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.6 tp -61.57 -59.96 4.42 Favored 'General case' 0 C--O 1.215 -0.726 0 C-N-CA 124.633 1.173 . . . . 72.33 107.941 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 33.0 t -55.82 -41.22 73.88 Favored 'General case' 0 C--N 1.35 0.601 0 O-C-N 124.557 1.16 . . . . 70.52 111.402 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 81.0 mt -57.7 -54.88 41.87 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.886 0.741 . . . . 71.33 111.481 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.21 -23.74 63.93 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 122.497 -0.127 . . . . 63.14 111.185 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.614 HD13 ' SD ' ' A' ' 122' ' ' MET . 95.8 mt -73.86 -28.38 61.55 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.769 0.828 . . . . 74.42 111.038 174.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 113' ' ' SER . 27.6 mm-40 -71.94 -43.67 64.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.025 0.53 . . . . 74.42 109.639 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.84 -50.07 26.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 116.036 -0.529 . . . . 64.32 112.046 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' GLU . . . . . 0.417 ' HB2' ' OE1' ' A' ' 120' ' ' GLN . 8.6 mm-40 -82.61 -57.61 3.26 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 111.936 0.347 . . . . 75.3 111.936 -171.439 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.417 ' OE1' ' HB2' ' A' ' 119' ' ' GLU . 24.5 mp0 -89.14 -29.85 19.04 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.519 0.328 . . . . 73.23 111.559 -176.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 56.39 61.84 2.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.465 1.106 . . . . 71.12 110.92 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.682 ' SD ' HD23 ' A' ' 45' ' ' LEU . 22.4 ptm -91.32 147.17 34.88 Favored Pre-proline 0 N--CA 1.476 0.843 0 CA-C-N 114.569 -1.196 . . . . 73.31 108.109 172.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo . . . . . 0 C--N 1.374 1.88 0 C-N-CA 122.225 1.95 . . . . 71.15 113.264 -174.73 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 27.4 m0 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 113.141 0.793 . . . . 71.22 113.141 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.43 -27.89 40.17 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.056 0.762 . . . . 20.4 113.056 -174.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -88.13 -43.25 11.8 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.121 0.569 . . . . 73.14 110.638 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.405 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 45.3 mt-10 -59.59 -34.69 73.06 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.2 1.0 . . . . 73.3 112.778 -177.076 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 55.8 m-20 -61.25 -64.39 0.97 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.338 0.655 . . . . 73.21 109.885 -176.169 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -61.45 -43.98 97.91 Favored 'General case' 0 C--O 1.213 -0.824 0 O-C-N 124.059 0.849 . . . . 64.45 110.864 -178.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.9 tm0? -64.88 -60.22 3.32 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.399 0.68 . . . . 61.43 110.878 -171.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -67.46 -43.91 79.92 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-N 114.906 -1.043 . . . . 71.23 111.023 -173.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.88 -32.35 72.78 Favored 'General case' 0 C--N 1.358 0.955 0 CA-C-N 116.103 -0.499 . . . . 43.53 111.945 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 31.2 t70 -65.8 -47.63 74.45 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.541 0.526 . . . . 71.14 110.569 176.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -58.51 -41.41 85.34 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 124.108 0.88 . . . . 50.42 111.18 177.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.4 t0 -64.96 -42.81 94.26 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.762 0.825 . . . . 63.54 111.724 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -62.36 -37.56 86.15 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.331 -0.849 . . . . 61.25 109.743 175.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 97.9 mtt180 -62.63 -43.07 99.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.837 0.455 . . . . 74.11 109.926 174.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.61 -22.13 62.57 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.018 0.824 . . . . 44.2 111.91 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.2 OUTLIER -81.72 -55.64 4.51 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 122.981 0.512 . . . . 75.54 110.022 176.086 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -69.32 -61.38 1.81 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.524 -0.762 . . . . 75.23 110.026 -175.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.3 ttm -86.06 72.14 10.47 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.269 -1.382 . . . . 74.5 107.269 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 CA--C 1.539 0.528 0 CA-C-N 115.373 -0.831 . . . . 64.3 109.668 -178.148 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 113.836 1.05 . . . . 74.0 113.836 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -61.33 -40.0 92.6 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.821 0.448 . . . . 63.44 112.08 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -68.8 -38.18 79.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.284 0.564 . . . . 72.11 109.66 -177.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -68.61 -34.48 75.85 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.081 0.952 . . . . 73.45 108.932 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -66.31 -37.94 86.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.93 0.492 . . . . 74.3 110.426 177.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 85.9 mt -57.21 -50.59 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.781 0.832 . . . . 64.13 110.52 171.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.617 HG23 ' HG2' ' A' ' 43' ' ' GLU . 19.5 mm -63.25 -42.85 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 115.668 -0.696 . . . . 72.04 111.305 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -63.53 -51.79 63.97 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 123.848 0.859 . . . . 63.01 110.471 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.434 HD11 ' HE2' ' A' ' 66' ' ' LYS . 82.4 mt -59.22 -53.0 63.28 Favored 'General case' 0 C--O 1.216 -0.699 0 O-C-N 124.04 0.838 . . . . 73.1 110.49 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.456 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -57.53 -38.62 88.26 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 124.64 1.212 . . . . 73.23 113.9 -177.009 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -74.4 -43.68 55.3 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 122.536 -0.39 . . . . 53.23 110.666 -179.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.84 -24.32 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.546 0.339 . . . . 64.14 110.353 175.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 35' ' ' VAL . 51.3 mt -64.43 -52.9 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.729 0.812 . . . . 62.02 108.913 171.146 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -54.34 -36.8 64.19 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 124.234 0.959 . . . . 73.42 111.25 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -72.04 -66.0 0.7 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.828 0.851 . . . . 75.14 111.34 178.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HD2' HG13 ' A' ' 76' ' ' ILE . 9.7 ptp180 -68.34 -19.31 64.64 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.732 0.813 . . . . 44.13 112.564 -170.586 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.9 t -64.59 -29.85 70.87 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.751 0.42 . . . . 71.53 110.874 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.44 -6.43 24.74 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.522 0.564 . . . . 71.24 112.522 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.81 -28.43 69.86 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 119.424 -0.322 . . . . 74.51 110.797 169.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' MET . . . . . 0.512 ' SD ' HD11 ' A' ' 85' ' ' ILE . 3.2 mmt -65.66 94.57 0.2 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.982 -0.748 . . . . 71.34 108.982 176.41 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -72.88 -26.69 61.53 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.816 0.817 . . . . 65.24 110.123 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' HD22 ' A' ' 151' ' ' LEU . 92.7 m-85 -93.88 -174.25 3.38 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.413 -1.721 . . . . 70.32 109.265 166.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.482 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 56.8 m 54.32 53.9 10.24 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.814 0.845 . . . . 71.21 112.8 174.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.0 -52.45 65.48 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.963 0.905 . . . . 73.33 112.14 -175.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 19.3 tptm -68.19 -47.83 66.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.279 -0.873 . . . . 75.15 110.993 -173.228 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 30' ' ' ARG . 19.1 mt-30 -73.02 -25.48 60.97 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.788 0.662 . . . . 75.0 112.788 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 t -71.19 -49.44 43.67 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.99 0.516 . . . . 65.53 110.271 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -73.35 -22.0 60.4 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.425 -0.807 . . . . 74.42 111.053 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.826 HH12 ' HB2' ' A' ' 98' ' ' PHE . 19.1 ttt-85 -63.12 -52.93 60.6 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.314 1.046 . . . . 75.54 110.043 169.449 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.87 -49.42 77.82 Favored 'General case' 0 C--N 1.359 1.011 0 O-C-N 123.843 0.714 . . . . 63.23 109.705 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.14 96.6 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 124.301 1.001 . . . . 51.32 112.895 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -63.12 -49.12 75.68 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.879 0.872 . . . . 72.0 111.019 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.487 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 84.1 mtt-85 -61.56 -56.37 20.72 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.053 0.846 . . . . 72.33 110.716 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.503 HG21 HG21 ' A' ' 14' ' ' ILE . 58.6 t -56.23 -46.44 81.38 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 O-C-N 124.296 0.997 . . . . 73.31 111.407 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 39' ' ' ILE . 72.3 mt -62.77 -40.98 98.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 123.443 0.465 . . . . 73.33 111.25 177.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.29 -27.56 71.78 Favored Glycine 0 CA--C 1.532 1.114 0 O-C-N 123.379 0.425 . . . . 75.42 112.951 177.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 47.9 mt -84.52 -47.75 10.28 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.305 0.642 . . . . 64.54 111.481 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 36' ' ' LEU . 22.4 pt -76.83 -40.28 31.64 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.357 0 CA-C-O 117.807 -1.092 . . . . 73.53 111.409 -171.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -54.39 -47.79 96.61 Favored Pre-proline 0 N--CA 1.493 1.675 0 N-CA-C 113.553 0.946 . . . . 75.15 113.553 -169.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.38 -48.01 23.81 Favored 'Trans proline' 0 C--N 1.401 3.315 0 C-N-CA 122.003 1.802 . . . . 53.54 111.395 171.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 4' ' ' LEU . 4.3 mm? -69.89 -25.23 63.6 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 124.087 0.867 . . . . 63.13 111.474 -177.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.617 ' HG2' HG23 ' A' ' 8' ' ' ILE . 43.4 mt-10 -67.22 -52.08 45.49 Favored 'General case' 0 C--N 1.354 0.783 0 N-CA-C 108.544 -0.91 . . . . 62.21 108.544 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 70.6 mtm -57.63 -45.85 84.9 Favored 'General case' 0 C--N 1.351 0.668 0 O-C-N 124.211 0.944 . . . . 54.44 110.306 177.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.9 mt -71.62 -21.57 61.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.732 0.813 . . . . 65.31 112.607 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -77.65 -53.11 7.95 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.581 0.753 . . . . 63.42 109.807 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 . . . . . 0 N--CA 1.482 1.17 0 O-C-N 123.681 0.613 . . . . 52.24 111.361 -179.091 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 109.91 -0.404 . . . . 42.31 109.91 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -59.94 -50.7 72.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.967 0.507 . . . . 75.34 110.741 -175.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.84 67.13 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.637 -0.71 . . . . 53.32 112.051 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 33.4 tp -66.72 -48.89 67.77 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.903 0.481 . . . . 71.1 110.047 177.182 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.8 m -60.52 -43.36 97.18 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 124.189 0.931 . . . . 74.41 110.136 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -56.46 -47.65 78.71 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 123.793 0.683 . . . . 53.13 110.959 176.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.44 98.77 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.373 0.669 . . . . 72.44 111.439 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.47 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.1 mmt -64.71 -34.09 77.49 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.292 0.637 . . . . 75.43 111.266 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -73.72 -35.29 65.09 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.218 0.607 . . . . 70.41 110.653 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -66.06 -39.58 90.21 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.688 0.795 . . . . 65.4 110.27 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.586 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 3.3 t80 -70.76 -42.45 70.43 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.188 0.995 . . . . 73.21 110.234 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.434 ' HE2' HD11 ' A' ' 10' ' ' LEU . 14.7 tmtt? -64.72 -38.92 92.63 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.48 1.112 . . . . 75.2 110.053 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.8 -40.6 92.05 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.381 0.673 . . . . 72.02 111.009 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.67 80.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.385 0.674 . . . . 73.23 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -72.09 -26.09 62.01 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.786 -0.643 . . . . 75.1 111.067 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.72 -34.37 71.84 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.906 0.482 . . . . 72.14 110.351 172.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.505 ' HB3' HG22 ' A' ' 101' ' ' VAL . 25.3 mm-40 -64.13 -44.46 92.14 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.985 -0.552 . . . . 65.12 110.878 175.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -63.29 -59.72 4.34 Favored 'General case' 0 C--N 1.354 0.796 0 O-C-N 123.454 0.471 . . . . 53.13 110.555 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -47.64 -46.35 28.8 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.019 1.728 . . . . 73.43 111.875 -176.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.2 -44.05 87.59 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.471 1.107 . . . . 60.34 113.416 -176.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.479 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . 25.4 mt-10 -67.06 -48.36 68.49 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 118.294 -0.86 . . . . 72.43 111.028 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.605 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.8 pt -66.37 -26.77 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 CA-C-N 118.704 0.684 . . . . 73.14 111.678 176.519 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -60.77 -40.96 94.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.11 0.564 . . . . 72.04 110.232 171.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -85.39 -22.65 28.29 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.874 0.694 . . . . 74.24 112.874 175.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.605 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.2 m-85 -79.33 -1.63 37.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.549 0.74 . . . . 71.35 111.68 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.4 p -56.74 -26.33 56.91 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.424 0.689 . . . . 63.51 110.775 172.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -82.73 112.4 19.55 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 107.548 -1.278 . . . . 75.32 107.548 162.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.496 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.7 mpt_? -70.78 -23.69 62.44 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.069 0.548 . . . . 62.02 110.821 -175.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 25.5 m -63.73 -33.97 76.85 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.158 0.983 . . . . 61.01 111.66 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -57.09 -45.82 83.04 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.157 0.983 . . . . 51.43 110.075 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' A' ' 21' ' ' MET . 21.1 mt -60.79 -54.82 29.99 Favored 'Isoleucine or valine' 0 C--N 1.352 0.694 0 O-C-N 124.248 0.967 . . . . 75.34 109.869 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 27.5 t -57.18 -38.03 73.01 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.585 0.553 . . . . 74.31 111.678 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -63.18 -47.93 80.53 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 124.184 0.927 . . . . 74.53 111.243 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.95 -29.88 50.09 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 110.096 -0.335 . . . . 71.32 110.096 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 11.7 tp -69.04 -39.05 79.42 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.934 0.894 . . . . 71.03 110.254 -172.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -78.01 -27.59 48.97 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.346 0.659 . . . . 43.33 110.84 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.72 -55.39 4.86 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.519 0.728 . . . . 52.3 111.189 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 108.834 -0.802 . . . . 53.15 108.834 175.1 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.475 HG23 ' HB2' ' A' ' 141' ' ' ALA . 3.3 mm . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 106.531 -1.655 . . . . 75.43 106.531 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -39.9 -48.25 2.29 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.158 0.983 . . . . 71.53 111.925 -173.008 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.826 ' HB2' HH12 ' A' ' 30' ' ' ARG . 72.7 m-85 -128.42 47.44 2.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.06 0.944 . . . . 70.45 111.256 176.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.1 -62.13 1.85 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 124.418 1.087 . . . . 71.32 111.571 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.07 -42.55 96.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.174 -1.375 . . . . 71.15 110.76 -175.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 71' ' ' GLU . 61.3 t -63.21 -41.72 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 114.829 -1.078 . . . . 74.22 111.498 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -71.65 -32.94 68.47 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.351 0.66 . . . . 71.5 110.578 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -63.4 -41.38 98.75 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 108.904 -0.776 . . . . 73.13 108.904 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 60.3 mttm -63.37 -49.1 75.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.575 -0.739 . . . . 60.51 110.683 174.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.81 -42.21 97.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.938 0.895 . . . . 74.42 111.22 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.462 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 37.4 t -71.12 -47.79 55.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.054 0.846 . . . . 52.12 110.198 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.569 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 27.3 t70 -57.82 -57.2 13.81 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 124.051 0.844 . . . . 64.43 110.381 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.1 -38.59 82.85 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 CA-C-N 114.945 -1.025 . . . . 63.21 111.272 -178.037 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -60.46 -42.06 95.42 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.189 0.45 . . . . 74.11 111.221 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.569 ' HE2' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtmt -58.91 -57.0 15.01 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 109.665 -0.494 . . . . 73.52 109.665 174.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.66 -44.56 69.76 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.569 0.748 . . . . 74.45 111.784 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.47 HD11 ' SD ' ' A' ' 62' ' ' MET . 9.1 tt -70.21 -55.94 8.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.292 1.437 . . . . 53.32 109.885 -172.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.0 t -61.87 -31.64 71.92 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.836 0.855 . . . . 74.04 111.326 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 51.5 mt -70.24 -51.16 32.83 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 122.963 0.505 . . . . 71.23 111.031 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.87 -24.3 65.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.047 0.385 . . . . 74.43 110.497 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.651 HD22 ' SD ' ' A' ' 122' ' ' MET . 42.2 mt -64.53 -55.51 20.13 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 119.239 -0.41 . . . . 52.53 110.415 172.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -68.77 -32.8 72.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.438 0.533 . . . . 74.02 112.438 -174.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.9 -60.92 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.131 0.572 . . . . 73.11 110.802 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -84.21 -55.93 3.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.251 0.62 . . . . 72.31 111.748 -169.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -82.86 -5.36 58.95 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 122.575 0.35 . . . . 70.43 111.723 -178.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 62.74 25.33 15.05 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.803 1.241 . . . . 73.41 112.344 172.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 116' ' ' LEU . 69.4 mtp -84.81 126.31 68.66 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.239 1.016 . . . . 63.03 109.998 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo . . . . . 0 C--N 1.374 1.915 0 C-N-CA 123.086 2.524 . . . . 61.12 113.44 -172.747 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 112.381 0.511 . . . . 73.22 112.381 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.3 67.39 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.927 0.491 . . . . 45.24 110.669 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -69.27 -31.22 69.6 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.829 -0.623 . . . . 75.21 111.046 -177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -55.72 -58.56 7.31 Favored 'General case' 0 C--O 1.211 -0.974 0 O-C-N 124.062 0.851 . . . . 62.44 110.407 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.63 -42.51 75.06 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.926 1.084 . . . . 75.4 113.926 -173.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.104 0.253 . . . . 75.44 110.857 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.96 -35.43 72.16 Favored 'General case' 0 C--N 1.359 1.0 0 O-C-N 123.099 0.249 . . . . 74.54 110.928 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -64.63 -56.42 13.94 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.986 -0.746 . . . . 40.13 108.986 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.475 ' HB2' HG23 ' A' ' 96' ' ' ILE . . . -58.11 -36.8 73.42 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 124.399 1.062 . . . . 34.34 111.95 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -56.93 -64.09 0.99 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 122.868 0.467 . . . . 64.34 110.155 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.69 -38.41 91.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.979 0.912 . . . . 75.43 111.922 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 18.2 t0 -86.01 -45.19 11.68 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.385 -0.825 . . . . 73.51 111.942 -165.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 145' ' ' ARG . . . . . 0.432 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 54.4 ttt-85 -65.45 -36.68 84.64 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.406 -0.59 . . . . 64.23 109.406 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 38.5 ttt180 -63.58 -44.45 94.02 Favored 'General case' 0 C--N 1.356 0.887 0 CA-C-N 116.013 -0.539 . . . . 72.22 110.514 173.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.36 -19.53 61.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.261 0.624 . . . . 63.33 112.576 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.482 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.7 OUTLIER -78.21 -60.47 2.36 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 109.138 -0.69 . . . . 63.23 109.138 176.29 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -70.39 -26.01 63.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.06 -0.973 . . . . 73.23 110.891 -173.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 41.9 ttp -117.31 56.85 0.81 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 107.388 -1.338 . . . . 73.13 107.388 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.406 HD22 ' CE1' ' A' ' 23' ' ' TYR . 59.9 tp . . . . . 0 C--N 1.351 0.673 0 CA-C-N 115.512 -0.767 . . . . 70.41 109.452 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.339 -0.245 . . . . 74.04 110.339 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -57.3 -51.16 70.51 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 109.432 -0.581 . . . . 73.32 109.432 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.37 -39.82 73.55 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.785 0.834 . . . . 61.43 111.247 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.52 -51.32 69.1 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.462 -0.94 . . . . 62.22 108.462 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -59.37 -52.75 64.27 Favored 'General case' 0 C--O 1.215 -0.725 0 O-C-N 123.788 0.68 . . . . 70.31 110.71 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.451 HG22 HD12 ' A' ' 8' ' ' ILE . 97.7 mt -52.92 -55.01 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.397 1.479 . . . . 62.0 112.365 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.451 HD12 HG22 ' A' ' 7' ' ' ILE . 1.7 mp -67.67 -36.88 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 124.046 0.938 . . . . 72.02 110.959 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.6 m -65.75 -46.03 80.36 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.343 0.657 . . . . 62.43 110.411 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.79 -44.44 86.27 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 123.72 0.808 . . . . 61.22 109.736 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.463 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -60.29 -53.4 45.94 Favored Glycine 0 C--N 1.347 1.164 0 O-C-N 124.251 0.969 . . . . 73.03 113.052 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.466 ' HG3' HD12 ' A' ' 39' ' ' ILE . 33.5 mt-30 -66.41 -31.95 73.03 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 112.033 0.383 . . . . 74.1 112.033 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -70.36 -36.92 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.331 0.653 . . . . 70.32 110.723 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.413 HG21 HG21 ' A' ' 35' ' ' VAL . 37.3 mt -58.77 -49.24 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.641 0.776 . . . . 72.24 109.056 175.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -56.47 -52.9 62.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.695 -1.139 . . . . 71.53 111.343 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -60.7 -57.61 11.95 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 123.799 0.687 . . . . 73.11 111.053 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -73.58 -17.19 61.21 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 112.683 0.623 . . . . 75.12 112.683 -173.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 45.7 t -60.41 -17.11 41.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.147 0.579 . . . . 71.21 111.578 170.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -55.13 -23.38 20.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.514 0.726 . . . . 74.45 112.175 172.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -66.02 -15.6 63.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.456 0.702 . . . . 64.13 112.036 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.0 mmt -78.14 82.69 4.46 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.858 -0.793 . . . . 71.41 108.858 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -35.45 73.9 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.781 -1.192 . . . . 65.42 107.781 173.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.423 ' HE2' HD22 ' A' ' 151' ' ' LEU . 70.7 m-85 -97.03 177.16 5.7 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.656 -1.156 . . . . 61.42 109.569 165.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 70.9 m 54.53 58.11 5.18 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.772 0.796 . . . . 74.15 109.835 -173.175 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -70.1 -49.83 46.9 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-N 114.255 -1.339 . . . . 75.4 110.872 -169.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 24.0 mmtp -61.1 -46.61 89.91 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 108.495 -0.928 . . . . 73.3 108.495 177.27 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -57.66 -36.09 71.43 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.343 1.027 . . . . 72.22 113.441 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 40.7 t -70.9 -42.32 70.1 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.405 0.44 . . . . 74.23 110.667 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -71.71 -28.3 63.6 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 115.71 -0.677 . . . . 73.32 110.945 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.698 ' HD2' ' HB3' ' A' ' 136' ' ' GLU . 33.7 ttp180 -82.6 -38.05 24.15 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.489 1.116 . . . . 73.44 109.788 -173.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.2 tp -65.75 -43.39 89.08 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.178 -1.045 . . . . 74.24 108.178 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.93 -35.36 90.37 Favored Glycine 0 C--N 1.351 1.398 0 O-C-N 123.753 0.658 . . . . 34.23 112.745 173.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -64.78 -51.52 61.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.344 0.658 . . . . 74.53 110.742 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.1 mtt-85 -57.6 -59.49 5.11 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.609 -1.178 . . . . 74.11 110.155 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.413 HG21 HG21 ' A' ' 14' ' ' ILE . 54.6 t -58.86 -52.38 61.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 124.668 1.23 . . . . 73.35 112.05 -174.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.28 -45.87 82.69 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 118.046 0.384 . . . . 63.34 110.349 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.41 -24.49 65.79 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 123.258 0.349 . . . . 53.11 113.494 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.458 ' O ' HD23 ' A' ' 42' ' ' LEU . 11.4 tp -86.84 -40.15 15.18 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.577 1.151 . . . . 52.44 112.071 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.466 HD12 ' HG3' ' A' ' 12' ' ' GLN . 15.6 pt -84.6 -33.76 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-O 119.275 -0.393 . . . . 74.03 111.792 -171.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -54.3 -53.76 55.6 Favored Pre-proline 0 N--CA 1.49 1.542 0 CA-C-O 117.992 -1.004 . . . . 71.21 113.131 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.773 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 20.8 Cg_endo -57.68 -38.66 92.5 Favored 'Trans proline' 0 C--N 1.396 3.053 0 C-N-CA 122.218 1.945 . . . . 43.22 112.243 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.5 mm? -66.64 -36.34 82.34 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.609 -0.723 . . . . 71.24 111.296 178.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -73.53 -29.42 62.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.913 0.885 . . . . 71.41 111.666 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.7 mmt -64.9 -33.39 75.91 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.828 0.451 . . . . 61.1 111.336 178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.38 -41.5 14.43 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.572 0.349 . . . . 73.33 111.773 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -58.86 -45.82 89.21 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.543 0.737 . . . . 75.42 111.95 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 123.435 0.694 . . . . 72.12 111.167 -171.775 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.2 p . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.197 -0.297 . . . . 71.34 110.197 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -54.21 -51.78 63.34 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.634 0.774 . . . . 74.35 110.85 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -55.85 -38.73 70.45 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.932 0.893 . . . . 70.32 112.351 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 62' ' ' MET . 62.0 tp -67.65 -51.89 44.56 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 124.059 0.944 . . . . 73.12 109.275 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.3 m -61.64 -36.69 81.51 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.281 1.032 . . . . 55.53 111.521 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.8 m -66.67 -47.78 71.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.334 0.654 . . . . 71.11 109.382 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 65' ' ' PHE . . . -56.43 -41.29 76.15 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.722 -0.672 . . . . 75.34 110.178 175.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' LEU . 25.1 mmt -67.25 -28.45 68.05 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.987 0.915 . . . . 70.14 111.934 177.504 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -70.29 -49.08 53.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.84 0.456 . . . . 54.22 110.767 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -68.19 -33.77 75.06 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 120.529 0.204 . . . . 74.41 110.562 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 1.8 t80 -61.1 -56.25 23.03 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.945 1.298 . . . . 75.11 109.674 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 48.8 tttm -55.77 -50.06 71.46 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.224 -1.353 . . . . 74.15 110.695 175.437 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.47 -49.86 69.08 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.104 0.961 . . . . 63.1 112.15 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.34 -28.85 64.37 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.412 0.685 . . . . 62.33 111.722 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.4 mt -75.64 -28.18 58.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.718 0.407 . . . . 74.32 111.696 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 51.4 mt-10 -69.92 -42.69 72.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 109.445 -0.576 . . . . 63.34 109.445 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 42.4 mt-10 -63.66 -45.38 90.42 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.979 -1.009 . . . . 72.32 110.354 176.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.6 98.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.278 0.631 . . . . 71.34 111.39 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -57.8 -44.8 86.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.763 1.225 . . . . 64.45 110.265 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -68.23 -32.98 77.03 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 114.764 -1.107 . . . . 44.41 113.209 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 48.7 mm-40 -68.0 -51.06 51.53 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 116.915 0.357 . . . . 72.22 110.866 -179.202 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.557 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -66.44 -28.79 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 118.269 0.486 . . . . 74.42 112.284 175.541 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -60.74 -41.71 95.93 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.867 -0.79 . . . . 52.05 108.867 172.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -69.25 -39.61 78.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.842 1.257 . . . . 54.31 111.008 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.473 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 18.4 m-85 -81.46 5.45 17.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.996 0.918 . . . . 74.51 112.443 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.9 p -56.7 -32.56 65.59 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.214 0.53 . . . . 65.41 110.199 171.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -86.99 117.56 25.79 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.922 -1.036 . . . . 70.23 109.209 168.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.576 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.4 mpt_? -78.87 -26.17 43.94 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.229 1.012 . . . . 64.13 109.803 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -61.26 -38.65 87.45 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.92 0.888 . . . . 65.14 110.601 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.64 -44.26 96.59 Favored 'General case' 0 C--O 1.257 1.45 0 C-N-CA 124.265 1.026 . . . . 75.42 110.595 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.449 HG12 ' CD1' ' A' ' 79' ' ' PHE . 19.6 mt -60.93 -54.86 29.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 CA-C-N 115.091 -0.958 . . . . 62.42 109.611 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.8 t -54.66 -43.05 72.06 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.556 0.743 . . . . 63.51 111.235 -177.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 49.3 ttm-85 -56.67 -54.98 39.83 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.508 1.13 . . . . 74.12 111.362 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.479 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.18 -26.32 56.07 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.508 -0.314 . . . . 74.21 110.541 -176.805 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp -71.24 -43.72 66.73 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.077 0.951 . . . . 71.22 110.701 -170.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.6 t -65.08 -19.81 66.17 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.074 -0.966 . . . . 73.14 110.805 177.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.55 -26.97 14.24 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.312 1.045 . . . . 71.44 112.175 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.477 0.921 0 C-N-CA 122.774 0.429 . . . . 62.33 110.255 -172.174 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 12.9 mt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 107.984 -1.117 . . . . 63.22 107.984 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.479 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 7.1 mp -53.26 -39.22 63.69 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.699 1.599 . . . . 73.11 112.2 175.145 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 81.6 m-85 -122.87 35.07 4.96 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.331 0.653 . . . . 72.11 111.16 -173.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.669 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 38.3 tttm -63.3 -52.42 62.01 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.066 0.848 . . . . 63.43 110.45 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -75.02 -37.63 61.72 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.653 -0.703 . . . . 61.11 110.737 -175.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.69 -39.08 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 122.598 0.359 . . . . 75.34 110.814 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.4 -25.33 50.72 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.082 0.553 . . . . 64.32 110.767 176.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.71 -43.93 97.9 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.63 -0.507 . . . . 64.44 109.63 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -58.68 7.41 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.375 -0.602 . . . . 75.32 109.375 171.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.4 mt -54.42 -32.55 57.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.823 0.849 . . . . 62.24 112.466 -177.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.9 t -78.36 -47.1 18.39 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.631 0.772 . . . . 71.23 111.237 -176.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.652 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 22.5 t70 -69.34 -41.36 76.75 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 121.427 0.632 . . . . 53.22 110.436 -177.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.18 -48.54 86.52 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 CA-C-N 114.792 -1.095 . . . . 74.45 109.706 171.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TRP . . . . . 0.602 ' HE3' HD23 ' A' ' 112' ' ' LEU . 10.6 t-105 -63.15 -25.62 68.43 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.333 0.653 . . . . 72.45 112.119 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.6 mtpt -63.66 -63.05 1.28 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.701 -0.851 . . . . 74.24 108.701 171.83 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.33 -47.23 72.75 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.91 0.862 . . . . 73.31 110.679 -177.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 109' ' ' TRP . 47.5 tp -60.11 -56.25 23.89 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 112.902 -1.954 . . . . 61.12 110.529 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 91.3 p -61.25 -33.86 74.21 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.562 0.345 . . . . 72.52 111.843 -176.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.3 mt -63.33 -54.86 30.32 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 123.814 0.696 . . . . 72.12 110.134 176.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 pp -69.38 -23.7 63.77 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 111.84 0.311 . . . . 75.32 111.84 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.443 HD13 ' SD ' ' A' ' 122' ' ' MET . 85.8 mt -70.78 -45.03 65.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.891 0.476 . . . . 55.23 111.28 174.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -79.29 -31.11 43.23 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 122.111 -0.368 . . . . 75.31 111.6 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 76.3 t -83.47 -48.64 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 C-N-CA 122.7 0.4 . . . . 64.11 110.965 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -90.85 -57.94 2.64 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.272 0.558 . . . . 64.52 111.22 -176.399 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -83.03 -0.76 50.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.577 -0.738 . . . . 73.42 111.644 -170.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 62.26 24.16 14.35 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.156 1.382 . . . . 63.31 113.44 171.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.773 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 49.1 ttm -78.06 131.66 69.15 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 123.936 0.894 . . . . 72.42 110.396 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 C--N 1.378 2.082 0 C-N-CA 122.127 1.885 . . . . 62.23 111.799 179.126 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.1 m0 . . . . . 0 N--CA 1.482 1.17 0 N-CA-C 113.364 0.876 . . . . 75.01 113.364 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.63 -55.28 16.01 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.155 0.582 . . . . 62.52 110.281 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -29.41 70.61 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.186 -0.915 . . . . 73.02 111.7 -177.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.698 ' HB3' ' HD2' ' A' ' 30' ' ' ARG . 34.9 mt-10 -57.04 -60.46 3.56 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.706 1.202 . . . . 73.42 110.787 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.608 ' HB3' HD13 ' A' ' 96' ' ' ILE . 32.5 m-20 -56.36 -39.8 73.48 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 116.293 -0.412 . . . . 74.22 111.431 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.23 -64.45 0.86 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 123.141 0.276 . . . . 73.52 111.043 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -62.36 -50.54 71.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.571 0.701 . . . . 53.54 110.674 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 3.1 m-20 -75.48 -40.54 57.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.234 -1.348 . . . . 73.44 112.135 -167.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ALA . . . . . 0.523 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.36 -22.39 59.24 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 118.923 0.783 . . . . 60.34 111.269 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 35.7 t70 -70.98 -34.5 71.46 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 109.76 -0.459 . . . . 72.52 109.76 169.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -68.62 -35.46 77.34 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.203 0.601 . . . . 63.45 111.199 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.38 -36.45 68.73 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.156 0.582 . . . . 73.35 110.467 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -58.37 -45.56 88.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.657 -1.156 . . . . 71.53 109.958 171.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 48.5 mtt180 -66.99 -39.9 87.24 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.321 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.439 ' O ' HD13 ' A' ' 151' ' ' LEU . . . -71.16 -23.01 61.98 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.287 0.635 . . . . 72.14 111.617 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 148' ' ' PHE . . . . . 0.454 ' HB3' HE21 ' A' ' 149' ' ' GLN . 0.1 OUTLIER -86.95 -60.5 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.415 0.626 . . . . 64.3 111.251 175.452 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 149' ' ' GLN . . . . . 0.454 HE21 ' HB3' ' A' ' 148' ' ' PHE . 33.1 mm-40 -82.69 -27.09 31.48 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.904 -1.044 . . . . 74.33 112.654 -165.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.1 ttm -100.04 -70.88 0.72 Allowed 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.788 -0.819 . . . . 72.25 108.788 173.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 147' ' ' ALA . 16.6 tp . . . . . 0 CA--C 1.558 1.261 0 C-N-CA 125.221 1.409 . . . . 64.03 111.818 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 121.349 0.595 . . . . 64.3 110.109 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -71.02 -29.28 65.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.692 -1.14 . . . . 74.52 110.842 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.473 HD21 HD12 ' A' ' 42' ' ' LEU . 0.9 OUTLIER -73.59 -40.17 64.08 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.162 -0.681 . . . . 74.15 109.162 -179.196 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.447 ' O ' ' HD3' ' A' ' 5' ' ' LYS . 6.8 tmtt? -71.38 -30.98 66.77 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.305 -0.998 . . . . 75.23 108.305 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.498 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 57.5 t-80 -64.61 -40.61 95.8 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 119.304 -0.379 . . . . 65.43 110.14 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 93.6 mt -56.83 -46.14 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 C-N-CA 124.262 1.025 . . . . 74.54 110.526 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.481 HD12 ' HG2' ' A' ' 43' ' ' GLU . 34.1 mm -54.54 -54.15 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 115.16 -0.927 . . . . 51.24 110.547 174.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.2 m -57.52 -40.1 78.03 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 124.409 1.084 . . . . 73.42 111.252 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 93.4 mt -61.18 -57.9 10.53 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 123.923 0.764 . . . . 75.3 109.99 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . 0.612 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.18 -36.04 73.17 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 124.65 1.219 . . . . 74.4 113.583 -176.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -62.8 -54.39 39.69 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.876 0.47 . . . . 63.5 110.904 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.62 -31.19 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.73 0.812 . . . . 61.45 111.269 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.549 HG23 HD11 ' A' ' 76' ' ' ILE . 36.5 mt -61.96 -60.12 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.612 1.165 . . . . 73.32 109.261 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -66.27 -27.83 68.24 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 123.249 0.343 . . . . 64.14 111.002 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -63.46 -48.41 77.82 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.712 . . . . 73.23 110.55 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -83.93 -16.2 45.1 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.001 0.521 . . . . 54.33 111.888 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.6 t -66.27 -21.58 66.29 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.056 0.543 . . . . 72.54 110.354 172.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.78 -21.59 66.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.6 0.76 . . . . 65.52 111.855 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -68.33 -14.15 62.79 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.205 0.602 . . . . 74.54 112.47 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.4 mmt -77.07 85.34 3.57 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.088 0.47 . . . . 65.52 110.352 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -40.79 76.55 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.673 -0.862 . . . . 72.42 108.673 167.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -106.81 164.82 11.79 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.484 -1.235 . . . . 72.35 109.216 170.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.625 ' SG ' HG21 ' A' ' 85' ' ' ILE . 29.3 m 58.93 53.26 5.78 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 124.342 1.026 . . . . 64.52 110.023 -167.048 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -73.84 -42.16 61.24 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.008 -1.451 . . . . 74.33 111.765 -170.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.482 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 22.5 tptp -74.33 -45.02 49.95 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.208 -0.905 . . . . 71.23 109.867 -170.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -76.23 -22.22 55.46 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 116.026 -0.534 . . . . 70.3 111.24 176.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 t -61.57 -50.92 70.7 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.756 -0.461 . . . . 53.53 109.756 169.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -62.07 -38.7 89.82 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.181 0.925 . . . . 75.4 111.288 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HB3' HH21 ' A' ' 34' ' ' ARG . 4.1 mmp_? -51.06 -61.72 2.06 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.383 0.427 . . . . 64.31 110.01 172.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.62 -46.44 80.93 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.522 1.139 . . . . 71.31 110.887 -175.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.31 -49.89 58.94 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.967 0.792 . . . . 52.2 113.179 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -59.36 -38.13 79.63 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.536 0.735 . . . . 61.35 111.261 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.564 HH21 ' HB3' ' A' ' 30' ' ' ARG . 14.5 mtt180 -60.44 -59.42 5.44 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 123.721 0.638 . . . . 71.23 110.477 175.59 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.527 HG21 HG21 ' A' ' 14' ' ' ILE . 53.6 t -57.68 -41.07 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 124.516 1.135 . . . . 61.3 111.467 -174.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.17 -43.23 98.86 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.704 0.628 . . . . 70.33 110.053 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.88 -22.55 72.16 Favored Glycine 0 CA--C 1.537 1.43 0 O-C-N 123.448 0.468 . . . . 72.13 113.442 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 39.4 mt -84.35 -44.78 13.44 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 122.833 0.453 . . . . 53.24 110.983 178.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' HA3' ' A' ' 11' ' ' GLY . 13.3 pt -85.17 -25.06 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-O 118.964 -0.541 . . . . 65.24 111.989 -172.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -54.41 -56.01 31.24 Favored Pre-proline 0 CA--C 1.571 1.787 0 C-N-CA 123.598 0.759 . . . . 72.23 112.336 -176.075 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -72.28 -33.82 8.65 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.025 1.817 . . . . 62.52 111.944 -175.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.473 HD12 HD21 ' A' ' 4' ' ' LEU . 4.4 mm? -65.37 -39.5 92.38 Favored 'General case' 0 C--N 1.352 0.685 0 O-C-N 123.934 0.771 . . . . 75.01 109.497 176.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' HD12 ' A' ' 8' ' ' ILE . 3.7 mm-40 -64.4 -39.92 94.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.107 0.963 . . . . 64.44 111.443 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 31.9 mmt -60.36 -53.52 56.59 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 123.658 0.599 . . . . 71.03 110.549 177.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.6 mt -71.5 -26.6 62.74 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.565 0.746 . . . . 63.41 112.187 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -46.42 26.36 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.964 0.906 . . . . 73.52 109.464 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 123.256 0.623 . . . . 72.22 110.771 -178.494 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 45.2 t . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 108.091 -1.077 . . . . 64.4 108.091 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.45 -44.83 81.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.749 0.42 . . . . 73.54 110.276 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -70.95 -29.16 65.09 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.835 0.854 . . . . 54.12 111.166 176.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.606 ' HB2' ' HB3' ' A' ' 55' ' ' SER . 1.7 tm? -62.17 -48.66 79.07 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 107.825 -1.176 . . . . 72.13 107.825 176.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -64.88 -41.31 95.73 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.94 -1.027 . . . . 71.22 110.587 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.8 m -60.77 -44.66 96.48 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.696 0.623 . . . . 73.41 110.668 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.95 97.53 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.769 0.827 . . . . 52.44 110.102 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.97 -26.11 64.88 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.322 0.649 . . . . 72.42 111.564 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -75.65 -39.49 57.61 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.198 0.599 . . . . 73.51 110.393 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -72.13 -33.29 67.67 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.53 0.732 . . . . 64.21 110.335 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.71 -48.01 64.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.293 1.037 . . . . 74.11 108.785 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -55.47 -53.29 58.12 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 124.592 1.157 . . . . 41.41 110.591 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.67 94.09 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.559 0.743 . . . . 75.02 111.531 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.452 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.65 -36.12 81.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.506 0.722 . . . . 62.23 111.38 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 mt -71.36 -33.59 69.71 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.875 0.47 . . . . 72.23 111.057 177.139 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -67.05 -34.89 78.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.681 0.392 . . . . 71.43 110.174 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 46.8 mt-10 -64.55 -44.12 91.78 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.626 -0.715 . . . . 74.11 110.741 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.91 -46.73 89.48 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 123.545 0.528 . . . . 74.1 110.646 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -56.87 -44.03 81.84 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.152 1.381 . . . . 74.33 110.22 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.01 -40.43 97.11 Favored Glycine 0 C--N 1.35 1.341 0 O-C-N 124.058 0.849 . . . . 73.51 113.322 178.598 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 8.4 mm-40 -59.9 -60.29 4.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.946 0.498 . . . . 74.25 110.509 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.554 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.4 pt -66.97 -20.31 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 112.586 0.588 . . . . 74.1 112.586 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -63.4 -48.74 76.58 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.819 -0.808 . . . . 71.44 108.819 171.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -76.18 -25.38 55.16 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.693 -0.685 . . . . 75.11 111.224 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-30 -75.35 -4.38 38.98 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.513 0.725 . . . . 33.4 112.549 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.4 p -57.43 -25.54 59.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.983 0.513 . . . . 65.52 111.42 173.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -90.98 111.93 23.59 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 107.986 -1.116 . . . . 71.12 107.986 169.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -76.56 -29.74 56.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.657 0.783 . . . . 70.34 110.911 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.7 p -69.9 -31.65 69.55 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.035 0.534 . . . . 71.34 110.642 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -62.89 -44.44 96.09 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 123.601 0.76 . . . . 71.21 110.172 174.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.625 HG21 ' SG ' ' A' ' 24' ' ' CYS . 34.5 mt -57.17 -55.06 22.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.155 0 O-C-N 124.337 1.023 . . . . 63.02 108.918 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 36.5 t -53.73 -39.94 65.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 124.2 0.938 . . . . 74.22 111.866 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -63.41 -43.77 96.54 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 123.918 0.761 . . . . 71.13 111.585 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -28.35 45.84 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 110.17 -0.307 . . . . 71.51 110.17 177.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.04 -26.5 43.14 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.454 1.102 . . . . 64.11 111.061 -167.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.1 t -76.92 -28.16 55.18 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.882 -0.599 . . . . 74.41 110.412 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.01 -44.69 29.95 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.554 0.742 . . . . 64.01 110.651 178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.0 p . . . . . 0 N--CA 1.473 0.707 0 C-N-CA 123.659 0.784 . . . . 73.11 109.007 177.315 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 137' ' ' ASP . 2.5 mp . . . . . 0 CA--C 1.551 0.991 0 N-CA-C 109.248 -0.649 . . . . 63.13 109.248 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.4 tp -47.53 -42.27 22.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.284 1.033 . . . . 63.42 111.331 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PHE . . . . . 0.554 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 32.7 m-85 -120.73 32.27 6.06 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 114.697 -1.138 . . . . 64.22 111.181 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -48.54 -63.22 1.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.905 0.882 . . . . 74.54 112.792 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.87 -48.91 67.34 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.896 0.879 . . . . 52.24 111.12 -174.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.62 -40.01 85.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 114.713 -1.13 . . . . 62.41 110.981 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -76.95 -28.85 55.36 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.1 0.56 . . . . 64.54 110.74 -176.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -61.88 -40.83 96.76 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 109.045 -0.724 . . . . 74.32 109.045 172.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.64 -48.64 71.5 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 123.762 0.663 . . . . 70.0 111.191 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.452 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -55.3 -47.05 76.16 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.277 0.631 . . . . 64.35 110.534 177.317 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 33.6 t -65.26 -49.89 67.86 Favored 'General case' 0 C--O 1.212 -0.917 0 O-C-N 124.347 1.03 . . . . 74.22 110.599 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -56.34 -56.38 21.79 Favored 'General case' 0 C--O 1.261 1.669 0 O-C-N 124.224 0.953 . . . . 72.45 110.734 -176.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 47.8 t -62.33 -42.04 93.95 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.185 0 CA-C-N 113.926 -1.488 . . . . 70.15 110.136 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 20.1 t-105 -62.94 -43.46 98.74 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.734 0.646 . . . . 74.12 112.289 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 106' ' ' SER . 47.7 mtmt -59.52 -56.35 23.09 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.783 -0.451 . . . . 74.12 109.783 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.57 -21.76 61.83 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.881 -0.6 . . . . 65.21 111.862 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 3.3 tp -66.35 -60.0 3.17 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 107.158 -1.423 . . . . 64.53 107.158 176.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.8 t -52.72 -41.74 64.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 114.428 -1.26 . . . . 52.21 111.018 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 89.8 mt -58.6 -60.39 3.89 Favored 'General case' 0 C--N 1.361 1.076 0 O-C-N 124.149 0.906 . . . . 65.1 111.346 177.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.31 -27.76 69.25 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 120.698 0.285 . . . . 75.43 111.741 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.575 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 83.1 mt -67.13 -56.56 9.44 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 123.205 0.602 . . . . 74.55 110.389 177.084 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.71 -31.34 66.63 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.357 0.502 . . . . 63.42 112.357 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 88.1 t -77.13 -57.36 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.438 0.461 . . . . 73.4 110.261 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -97.04 -57.32 2.3 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.099 0.56 . . . . 74.32 111.16 -168.523 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -1.49 22.0 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.267 0.627 . . . . 62.12 111.37 -175.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 65.62 12.42 8.22 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.632 1.573 . . . . 72.45 112.182 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' MET . . . . . 0.575 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 66.8 mtp -87.01 110.96 37.18 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.176 0.99 . . . . 72.34 110.691 -173.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo . . . . . 0 C--N 1.372 1.78 0 C-N-CA 123.19 2.593 . . . . 64.42 111.4 -177.218 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 133' ' ' TRP . . . . . 0.424 ' HA ' ' HB2' ' A' ' 136' ' ' GLU . 47.4 m0 . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 112.187 0.44 . . . . 75.44 112.187 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.9 74.51 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 122.782 0.433 . . . . 63.22 111.544 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -89.73 -39.69 12.99 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.644 0.778 . . . . 72.12 111.135 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 133' ' ' TRP . 20.5 mm-40 -65.92 -64.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.076 0.55 . . . . 62.02 110.878 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' ASP . . . . . 0.44 ' HB3' HG21 ' A' ' 96' ' ' ILE . 3.7 m-20 -48.14 -36.56 13.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.554 1.142 . . . . 71.43 112.324 178.118 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -66.83 -58.7 4.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.73 0.812 . . . . 75.1 111.269 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.89 -39.05 87.8 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.445 0.641 . . . . 73.13 110.754 -177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -65.81 -39.29 90.75 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 114.479 -1.237 . . . . 75.2 110.229 176.942 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.03 -48.9 79.81 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.648 0.379 . . . . 74.25 111.03 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.04 -54.05 51.33 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 124.248 0.967 . . . . 72.34 111.298 177.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -76.6 -21.96 54.86 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.33 0.863 . . . . 74.41 113.33 -172.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ASP . . . . . 0.482 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 32.4 t0 -86.71 -34.55 19.66 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.917 -0.401 . . . . 64.55 109.917 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -65.95 -38.19 87.95 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.043 -0.526 . . . . 72.43 109.985 168.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -64.3 -41.83 96.66 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.37 -0.832 . . . . 71.31 109.576 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.28 -27.57 60.8 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.502 0.721 . . . . 74.43 111.931 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.18 -58.29 3.36 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.461 -0.57 . . . . 64.01 109.461 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -67.59 -44.3 78.45 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.655 -1.157 . . . . 74.14 111.255 -172.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 46.6 ttm -83.7 -79.3 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.33 -0.618 . . . . 72.15 109.33 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 61.0 tp . . . . . 0 N--CA 1.484 1.271 0 C-N-CA 124.457 1.103 . . . . 75.4 111.202 -172.661 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ptp . . . . . 0 N--CA 1.484 1.227 0 CA-C-O 119.648 -0.215 . . . . 72.23 110.804 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.02 -61.48 2.42 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.143 0.977 . . . . 75.32 112.855 -168.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.69 -37.51 87.63 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.303 0.641 . . . . 71.44 110.441 -174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.646 ' HG ' ' SD ' ' A' ' 62' ' ' MET . 7.4 tt -62.46 -40.73 97.59 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.837 -1.074 . . . . 74.23 109.836 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.64 -32.0 71.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.692 0.797 . . . . 74.44 110.519 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -63.98 -40.01 95.42 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 119.336 -0.364 . . . . 75.5 110.659 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.498 HD13 ' HB3' ' A' ' 65' ' ' PHE . 29.4 mt -59.51 -46.05 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 CA-C-O 120.979 0.419 . . . . 74.12 110.493 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 4' ' ' LEU . 46.1 mm -61.98 -45.7 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.101 -0.954 . . . . 75.31 111.139 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.7 m -62.75 -53.04 60.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.791 0.836 . . . . 65.44 110.248 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.6 mt -50.13 -47.24 54.22 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 124.487 1.117 . . . . 73.53 110.221 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.444 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.42 -52.81 50.56 Favored Glycine 0 C--N 1.342 0.877 0 O-C-N 124.243 0.964 . . . . 75.14 113.809 -175.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.0 -40.28 94.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.585 0.354 . . . . 71.33 111.286 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 65.2 t -64.91 -38.52 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 115.798 -0.637 . . . . 52.21 110.825 176.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.557 HD11 ' O ' ' A' ' 69' ' ' LEU . 20.1 mt -63.65 -51.46 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.45 1.1 . . . . 74.02 110.079 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.512 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 69.8 t60 -54.91 -46.76 74.92 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.46 1.1 . . . . 73.31 109.632 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.1 tptm -62.63 -53.71 50.51 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 124.505 1.128 . . . . 73.43 111.91 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.6 ptp180 -74.48 -22.67 58.97 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.792 0.437 . . . . 64.34 111.772 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.511 ' SG ' HD23 ' A' ' 31' ' ' LEU . 52.4 t -67.0 -26.0 66.58 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.609 0.364 . . . . 50.33 111.292 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HG3' ' O ' ' A' ' 15' ' ' HIS . 44.4 mt-10 -74.32 5.72 4.3 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 112.966 0.728 . . . . 71.14 112.966 -175.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.479 ' HG3' ' NH1' ' A' ' 82' ' ' ARG . 14.8 pt-20 -86.15 -13.85 45.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.687 0.395 . . . . 74.34 111.439 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.527 ' HA ' ' HD2' ' A' ' 82' ' ' ARG . 14.2 mmt -76.24 95.07 3.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.846 0.458 . . . . 55.51 110.452 -176.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -73.07 -32.64 65.14 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.321 0.582 . . . . 74.24 109.937 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -94.61 153.8 17.67 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.335 -0.987 . . . . 71.14 108.335 166.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' HD11 ' A' ' 97' ' ' LEU . 95.3 m 60.51 55.33 3.46 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 124.131 0.894 . . . . 70.11 110.342 -170.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.81 -48.2 59.96 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.183 -0.917 . . . . 63.14 111.022 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.3 mtpm? -72.7 -32.99 66.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.881 0.472 . . . . 74.44 110.421 -173.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG2' HH12 ' A' ' 30' ' ' ARG . 48.0 mt-30 -71.64 -31.09 66.47 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.368 0.267 . . . . 74.44 111.174 172.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.6 t -67.41 -39.44 85.53 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.257 0.623 . . . . 63.54 110.532 173.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -74.4 -32.12 62.59 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 114.849 -1.069 . . . . 72.12 110.749 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.567 HH12 ' HG2' ' A' ' 27' ' ' GLN . 40.0 ttp-105 -77.61 -39.91 43.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.32 0.648 . . . . 74.41 110.205 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.511 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.6 tp -61.25 -47.14 87.38 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.713 -0.847 . . . . 73.11 108.713 172.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.37 -41.09 98.34 Favored Glycine 0 C--N 1.351 1.415 0 O-C-N 123.928 0.767 . . . . 54.53 113.004 176.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -59.98 -51.85 67.92 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.063 0.945 . . . . 74.44 110.677 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.584 ' NH2' ' HB3' ' A' ' 133' ' ' TRP . 34.9 mtt180 -59.78 -62.39 1.91 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.201 -1.363 . . . . 72.51 110.632 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.4 t -51.13 -46.31 31.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 124.453 1.096 . . . . 44.23 111.951 -173.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.559 HD23 HD11 ' A' ' 39' ' ' ILE . 94.7 mt -67.46 -44.25 79.1 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.415 0.447 . . . . 64.2 110.745 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.38 -19.44 62.13 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.266 0.354 . . . . 75.33 113.741 175.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 81.0 mt -86.69 -52.58 5.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.825 0.85 . . . . 71.35 111.995 177.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.559 HD11 HD23 ' A' ' 36' ' ' LEU . 12.7 pt -73.99 -46.69 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 118.758 -0.639 . . . . 72.23 111.769 -169.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.502 ' HE2' ' HB3' ' A' ' 36' ' ' LEU . 68.3 mttm -53.57 -50.22 84.38 Favored Pre-proline 0 N--CA 1.489 1.506 0 CA-C-O 118.416 -0.802 . . . . 63.13 113.094 -173.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.489 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 49.4 Cg_exo -55.87 -54.02 4.7 Favored 'Trans proline' 0 C--N 1.395 3.005 0 C-N-CA 121.963 1.775 . . . . 43.41 112.045 176.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HA ' HD12 ' A' ' 45' ' ' LEU . 4.3 mm? -64.39 -23.36 67.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.488 0.715 . . . . 62.23 111.647 -176.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 45.7 mt-10 -71.65 -44.18 64.77 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.739 0.816 . . . . 71.13 110.572 172.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 32.7 mmt -69.55 -26.89 64.71 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.529 0.518 . . . . 73.2 110.983 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 42' ' ' LEU . 39.2 mt -78.61 -37.14 43.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 64.03 109.987 176.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -68.84 -32.63 72.45 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 115.648 -0.705 . . . . 73.52 110.123 174.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.17 -52.82 24.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.404 1.082 . . . . 73.35 110.907 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -68.31 -25.87 65.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.918 -0.583 . . . . 75.1 110.841 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.56 99.91 1.41 Allowed Glycine 0 C--N 1.349 1.276 0 CA-C-N 115.963 -0.562 . . . . 45.13 112.308 176.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.87 119.7 26.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 107.925 -1.139 . . . . 73.04 107.925 177.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -55.18 129.87 39.87 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.098 0.959 . . . . 72.34 112.431 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.7 m -78.6 84.36 4.72 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.401 0.68 . . . . 64.53 110.217 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.4 p -167.59 75.98 0.96 Allowed Pre-proline 0 CA--C 1.556 1.176 0 CA-C-N 114.721 -1.127 . . . . 60.43 108.903 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -86.13 109.86 1.0 Allowed 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.489 2.126 . . . . 44.21 112.484 177.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.473 ' H ' HD12 ' A' ' 58' ' ' LEU . 4.5 m -62.26 172.58 1.42 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.065 0.946 . . . . 74.11 110.609 171.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.06 -42.73 77.09 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.796 0.438 . . . . 63.33 110.075 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.53 -45.68 88.38 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.09 -0.959 . . . . 64.33 111.75 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.473 HD12 ' H ' ' A' ' 55' ' ' SER . 97.6 mt -74.14 -37.08 64.15 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.816 0.846 . . . . 72.23 111.115 -172.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 67.0 m -62.6 -55.46 26.9 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.95 0.781 . . . . 71.41 109.203 175.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 26.4 m -62.89 -36.03 81.97 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.755 -0.657 . . . . 74.41 111.246 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.53 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.08 -48.93 74.27 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.388 0.675 . . . . 53.12 111.016 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.646 ' SD ' ' HG ' ' A' ' 4' ' ' LEU . 32.8 mmt -68.54 -30.08 68.79 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.548 -0.751 . . . . 72.34 111.992 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -76.37 -36.72 57.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.537 0.335 . . . . 70.43 111.165 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -67.41 -41.92 84.1 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.604 0.762 . . . . 71.45 109.512 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.513 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.03 -49.41 65.32 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.364 -0.834 . . . . 65.41 109.511 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.3 ttpp -53.59 -51.69 62.19 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.619 0.574 . . . . 73.1 110.267 178.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.98 89.51 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.263 0.977 . . . . 74.13 112.093 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.559 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.97 -44.5 92.56 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.755 0.822 . . . . 62.32 111.102 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.557 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -69.77 -29.45 66.79 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.247 -0.888 . . . . 75.42 110.708 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.7 mt-10 -65.76 -38.48 89.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.584 -0.697 . . . . 61.14 109.856 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.441 ' HB2' HG13 ' A' ' 101' ' ' VAL . 44.0 mt-10 -61.84 -52.2 65.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.45 -0.795 . . . . 73.42 110.144 174.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.7 79.93 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 123.876 0.735 . . . . 74.11 111.367 -178.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -59.64 -48.3 82.2 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.698 1.199 . . . . 61.31 110.645 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.23 91.71 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.195 -0.911 . . . . 35.31 113.18 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -67.77 -54.01 22.65 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 119.073 -0.489 . . . . 73.24 110.95 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.462 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -63.31 -33.71 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 112.02 0.378 . . . . 72.15 112.02 177.679 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.16 -33.22 75.5 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 120.973 0.416 . . . . 71.53 110.262 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -80.73 -27.78 36.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.5 0.72 . . . . 41.42 110.855 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.402 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.3 m-85 -87.1 9.4 19.96 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.004 0.922 . . . . 73.45 111.32 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -57.16 -16.79 8.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.073 0.949 . . . . 72.32 112.306 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -110.3 115.14 29.15 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 108.027 -1.101 . . . . 72.44 108.027 167.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.527 ' HD2' ' HA ' ' A' ' 21' ' ' MET . 1.0 OUTLIER -72.82 -24.65 60.93 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.423 0.689 . . . . 61.02 111.373 178.652 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 p -64.95 -37.47 87.75 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.311 0.644 . . . . 63.24 110.326 170.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.79 -38.28 86.21 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.856 0.862 . . . . 65.32 110.601 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.486 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.2 mt -57.7 -49.16 81.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 108.862 -0.792 . . . . 74.12 108.862 175.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.01 -35.08 79.02 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.425 0.453 . . . . 74.15 111.606 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -60.8 -45.11 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.699 0.624 . . . . 74.42 111.054 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.411 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -80.54 -27.51 37.56 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 110.384 -0.228 . . . . 62.22 110.384 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 14.6 tp -67.61 -44.25 78.5 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.518 1.127 . . . . 52.15 111.164 -171.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -65.63 -13.58 59.41 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.868 -1.06 . . . . 74.31 111.65 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.26 -21.75 12.4 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.082 0.953 . . . . 74.31 111.402 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.1 t -68.65 113.44 6.15 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.948 0.899 . . . . 53.11 110.147 -175.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -69.0 -33.99 74.56 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.26 1.024 . . . . 51.41 111.091 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -83.16 148.27 27.56 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.757 -0.831 . . . . 70.44 108.757 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -96.49 18.58 13.74 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 74.04 110.84 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.541 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 7.0 mt -124.14 128.72 74.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 C-N-CA 124.33 1.052 . . . . 71.11 108.259 -178.086 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.557 HD11 ' SG ' ' A' ' 24' ' ' CYS . 20.2 mt -65.87 -54.1 31.11 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 122.142 0.972 . . . . 73.21 109.621 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.478 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 21.9 m-85 -94.44 36.72 1.14 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.628 -1.624 . . . . 74.24 109.947 -174.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.541 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 1.6 tmmt? -52.53 -62.46 1.63 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.152 0.433 . . . . 74.35 110.844 -176.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -61.85 -60.84 3.05 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.262 0.625 . . . . 74.43 110.802 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.9 t -50.34 -57.85 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.898 1.279 . . . . 64.42 112.807 -174.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.458 ' HA ' HD13 ' A' ' 105' ' ' LEU . 65.3 t30 -73.83 -22.25 59.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.985 -1.007 . . . . 64.44 110.349 -174.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.1 -43.65 95.39 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.203 -0.427 . . . . 73.25 110.126 166.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -56.75 -46.91 81.11 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 119.386 -0.34 . . . . 71.21 110.665 172.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.559 HD12 ' HB1' ' A' ' 68' ' ' ALA . 9.9 mp -53.21 -41.66 65.55 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 117.784 0.265 . . . . 52.2 111.142 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.439 ' HA ' ' HE3' ' A' ' 133' ' ' TRP . 38.9 t -67.53 -43.94 79.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.884 0.874 . . . . 43.45 111.577 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 68.7 m-20 -69.79 -55.16 10.59 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.411 -0.813 . . . . 72.35 110.243 -177.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.407 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.7 t -63.28 -32.75 57.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 119.532 -0.271 . . . . 54.53 111.225 -176.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.614 ' HH2' HG12 ' A' ' 124' ' ' VAL . 16.4 t-105 -67.46 -48.18 67.95 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.02 -0.514 . . . . 74.44 111.738 174.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 41.4 pttt -60.72 -42.09 96.58 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 109.327 -0.62 . . . . 74.44 109.327 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.39 -35.56 75.91 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.391 1.076 . . . . 71.53 110.607 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.53 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.3 OUTLIER -61.14 -59.81 4.74 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 107.948 -1.131 . . . . 65.21 107.948 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.9 t -53.97 -35.49 61.87 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.905 -1.498 . . . . 62.41 110.973 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.2 mt -63.22 -62.95 1.35 Allowed 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.154 0.582 . . . . 62.41 111.533 172.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.48 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 3.8 pp -63.19 -28.61 70.16 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.134 0.42 . . . . 73.13 112.134 -173.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 91.7 mt -65.28 -57.9 7.28 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.292 -0.867 . . . . 72.34 109.878 173.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -68.17 -23.72 64.89 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 112.18 0.437 . . . . 72.34 112.18 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 85.4 t -83.94 -63.96 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.376 0.271 . . . . 71.21 111.003 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -93.87 -44.48 8.08 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 122.253 -0.279 . . . . 52.35 111.537 -170.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -71.21 -17.63 62.51 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 116.674 -0.239 . . . . 73.15 110.481 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 65.82 9.73 6.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.741 1.617 . . . . 74.21 111.363 -177.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.537 ' HG2' HG23 ' A' ' 124' ' ' VAL . 33.1 ttp -94.61 111.12 52.81 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.476 1.11 . . . . 75.35 109.432 -170.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 41.2 Cg_endo -90.41 43.85 0.55 Allowed 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 124.004 3.136 . . . . 72.24 112.915 -165.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.614 HG12 ' HH2' ' A' ' 109' ' ' TRP . 86.6 t -65.75 103.16 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.043 0.937 . . . . 64.43 111.285 -175.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 39.9 t -162.0 79.45 1.98 Allowed Pre-proline 0 CA--C 1.546 0.824 0 CA-C-N 114.386 -1.279 . . . . 72.23 108.108 172.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.489 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 61.4 Cg_endo -81.79 27.21 0.59 Allowed 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 123.156 2.571 . . . . 64.43 112.775 177.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.427 HD11 ' HE1' ' A' ' 133' ' ' TRP . 13.3 tt -145.24 -58.59 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 122.562 0.345 . . . . 73.44 111.582 -168.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 29.7 p -175.82 -68.1 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.28 0.632 . . . . 74.4 109.854 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.73 -57.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.028 -1.471 . . . . 71.41 107.028 -174.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.67 -7.04 10.39 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.977 -1.01 . . . . 43.24 113.909 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.17 -39.28 29.62 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 117.661 0.731 . . . . 51.22 111.138 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 m -62.92 -13.11 30.39 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.65 1.18 . . . . 30.33 112.605 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.584 ' HB3' ' NH2' ' A' ' 34' ' ' ARG . 12.3 m0 -58.82 -18.04 28.96 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.122 1.369 . . . . 75.53 113.983 176.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.35 93.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.289 0.236 . . . . 65.13 110.792 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -72.58 -32.34 65.93 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.393 0.677 . . . . 64.15 111.319 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HG2' ' HD2' ' A' ' 30' ' ' ARG . 29.4 tt0 -61.99 -58.67 6.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.694 0.798 . . . . 75.32 109.973 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -37.83 83.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.061 0.544 . . . . 75.1 111.835 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 142' ' ' ASP . 33.3 tt0 -56.01 -63.76 1.08 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.79 0.681 . . . . 73.4 110.948 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -71.46 -46.19 60.6 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.524 0.515 . . . . 73.44 110.862 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.94 -43.01 72.48 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.923 -0.58 . . . . 61.44 111.129 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 96' ' ' ILE . . . -78.05 -25.36 47.71 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 123.212 0.32 . . . . 71.2 111.096 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 138' ' ' GLN . 13.6 t70 -58.21 -53.72 55.1 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.318 -0.623 . . . . 70.22 109.318 170.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -58.65 -44.61 90.16 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 114.341 -1.3 . . . . 72.41 111.693 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 34.0 t70 -80.88 -32.25 34.97 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.952 0.782 . . . . 72.43 112.87 -168.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' A' ' 89' ' ' LEU . 3.6 tmt_? -70.2 -41.33 73.82 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.288 -1.005 . . . . 74.44 108.288 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 ttm180 -62.42 -37.44 85.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 114.726 -1.124 . . . . 73.23 109.954 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.87 -17.82 59.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.438 0.695 . . . . 73.34 111.396 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.488 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 1.6 t80 -69.98 -59.81 2.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.238 -1.023 . . . . 63.35 108.238 171.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -70.92 -38.65 72.95 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 113.874 -1.512 . . . . 52.33 111.595 -170.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 87.4 mmm -103.55 31.7 4.25 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.196 0.999 . . . . 71.23 110.131 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 154' ' ' ASP . 2.0 tt -76.38 84.91 3.14 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-O 121.583 0.706 . . . . 65.21 109.574 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -116.36 -11.46 11.21 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.68 1.192 . . . . 74.53 109.423 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -61.05 -48.98 79.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.289 1.436 . . . . 64.54 111.964 -177.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.543 ' HB3' HD21 ' A' ' 151' ' ' LEU . 39.1 t70 -91.08 25.54 2.43 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-O 121.982 0.896 . . . . 71.23 109.987 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -122.94 81.58 1.89 Allowed 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.666 -0.865 . . . . 63.41 108.666 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.561 1.372 0 C-N-CA 125.328 1.451 . . . . 74.02 111.846 -177.413 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 110.255 -0.276 . . . . 74.41 110.255 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.27 -55.24 26.41 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 124.055 0.942 . . . . 64.44 111.238 -175.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -59.65 -35.03 73.6 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.784 0.677 . . . . 73.44 111.562 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 30.5 tp -66.71 -44.56 81.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.888 0.475 . . . . 65.31 110.549 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -70.21 -25.35 63.36 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.791 0.436 . . . . 74.23 110.633 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.3 m80 -77.64 -29.96 51.98 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-O 118.993 -0.527 . . . . 72.13 110.768 173.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.46 -44.91 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 109.2 -0.667 . . . . 74.43 109.2 170.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 mm -60.42 -51.52 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-N 114.5 -1.227 . . . . 64.54 110.842 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.8 m -65.09 -56.77 11.09 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.329 0.652 . . . . 65.33 111.075 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.2 mt -51.7 -51.54 55.22 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.965 0.906 . . . . 72.3 111.199 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.26 -35.24 90.06 Favored Glycine 0 C--N 1.346 1.126 0 O-C-N 124.272 0.983 . . . . 74.12 114.05 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -69.16 -42.8 75.44 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.22 0.533 . . . . 65.13 109.729 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 62.8 t -62.06 -37.72 79.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-N 114.923 -1.035 . . . . 74.13 110.139 174.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.457 HG12 HD11 ' A' ' 76' ' ' ILE . 32.8 mt -58.04 -52.21 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.758 0.823 . . . . 73.14 110.131 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -60.16 -36.29 77.23 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.004 0.815 . . . . 73.32 110.982 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -66.29 -66.98 0.48 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 119.541 -0.266 . . . . 71.34 111.454 175.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -63.78 -20.17 65.56 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.355 0.872 . . . . 73.25 113.355 -172.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.5 t -65.33 -20.53 66.44 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.067 0.547 . . . . 72.21 112.077 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.28 -18.07 24.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.781 0.832 . . . . 65.23 113.07 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -65.85 -21.51 66.47 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.337 0.866 . . . . 62.31 113.337 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.525 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 7.6 mmt -75.57 87.7 2.68 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 121.16 0.505 . . . . 54.14 110.493 -173.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -35.59 63.79 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.787 -1.097 . . . . 70.41 108.447 170.146 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -92.64 152.89 19.31 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 108.129 -1.063 . . . . 71.2 108.129 169.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.5 p 50.54 60.11 4.09 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.243 1.017 . . . . 45.13 110.413 -171.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 47.4 mtmt -66.58 -45.32 79.62 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 114.491 -1.231 . . . . 61.21 111.371 -174.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -71.42 -36.8 71.43 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 108.194 -1.039 . . . . 72.0 108.194 -170.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.479 HE22 ' HB2' ' A' ' 141' ' ' ALA . 0.0 OUTLIER -56.45 -43.86 79.94 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.066 1.346 . . . . 73.01 112.231 169.092 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 32.8 t -60.94 -39.79 90.83 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.683 0.793 . . . . 72.34 110.889 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.9 mpt_? -81.23 -22.44 38.76 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.628 0.771 . . . . 74.54 111.1 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.45 -60.45 2.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.632 0.773 . . . . 73.3 109.166 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 29.0 tp -58.23 -40.52 81.9 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.425 1.09 . . . . 73.43 110.196 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.04 -51.04 59.73 Favored Glycine 0 C--N 1.354 1.54 0 O-C-N 123.965 0.791 . . . . 71.15 112.458 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -71.59 -32.99 68.65 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.082 0.553 . . . . 74.4 111.387 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.796 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.9 mtt180 -62.37 -63.58 1.19 Allowed 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.419 0.449 . . . . 61.42 109.812 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 14' ' ' ILE . 99.8 t -65.09 -41.14 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.549 -0.75 . . . . 72.44 111.219 -173.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.8 -40.94 98.9 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.344 0.592 . . . . 73.31 109.893 175.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.1 -22.09 75.84 Favored Glycine 0 C--O 1.216 -1.006 0 CA-C-N 114.702 -1.135 . . . . 51.21 113.083 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 90.5 mt -84.42 -39.7 18.68 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 117.838 0.819 . . . . 62.31 111.372 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 pt -81.66 -39.18 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 112.447 0.536 . . . . 74.53 112.447 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 44' ' ' MET . 31.2 mmtp -60.07 -53.79 61.7 Favored Pre-proline 0 N--CA 1.485 1.304 0 CA-C-O 118.004 -0.998 . . . . 71.4 112.518 -174.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 27.2 Cg_endo -60.17 -41.26 52.95 Favored 'Trans proline' 0 C--N 1.399 3.222 0 C-N-CA 122.08 1.853 . . . . 72.23 110.539 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.46 HD13 HD11 ' A' ' 45' ' ' LEU . 3.9 mm? -60.67 -35.66 76.8 Favored 'General case' 0 C--N 1.356 0.868 0 O-C-N 124.286 0.991 . . . . 75.21 111.667 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.16 -44.9 67.84 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.798 0.439 . . . . 73.43 110.943 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 36.2 mmt -57.13 -51.76 68.02 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.099 0.874 . . . . 74.34 110.265 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 41' ' ' PRO . 3.5 pp -77.16 -27.5 53.82 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.203 -0.453 . . . . 71.15 111.721 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -59.45 -39.14 82.64 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.654 0.661 . . . . 72.44 110.153 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -82.32 -45.04 15.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.157 -0.929 . . . . 62.43 111.562 -177.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -78.19 -58.86 3.03 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.964 0.505 . . . . 70.1 111.589 -176.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.15 91.87 0.09 OUTLIER Glycine 0 C--N 1.346 1.107 0 N-CA-C 112.162 -0.375 . . . . 65.54 112.162 -176.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -90.03 -32.34 16.79 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.463 1.105 . . . . 73.33 110.988 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 75.18 110.47 0.07 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.857 1.663 . . . . 71.24 109.556 -164.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.8 p -76.81 -171.28 1.87 Allowed 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.799 -1.091 . . . . 62.23 111.031 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 58.1 t 61.43 83.94 0.2 Allowed Pre-proline 0 C--O 1.244 0.765 0 C-N-CA 124.627 1.171 . . . . 73.51 109.566 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.571 ' HA ' HD23 ' A' ' 58' ' ' LEU . 58.7 Cg_endo -71.93 128.09 13.67 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 121.928 1.752 . . . . 72.12 111.341 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 p -64.96 169.18 5.52 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.387 0.675 . . . . 64.21 110.321 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -57.09 -51.33 69.74 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.15 0.58 . . . . 71.12 110.918 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -72.25 -27.25 62.39 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.33 -0.85 . . . . 55.44 111.883 -179.169 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.571 HD23 ' HA ' ' A' ' 54' ' ' PRO . 52.8 tp -72.55 -43.6 63.25 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.885 -0.413 . . . . 71.44 109.885 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.3 m -62.17 -49.68 74.85 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 123.787 0.835 . . . . 74.11 109.36 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 54.8 m -54.71 -44.93 73.89 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.038 0.935 . . . . 74.13 110.826 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.89 -38.57 89.09 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.634 0.774 . . . . 63.14 111.198 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.82 -30.44 66.87 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.914 0.485 . . . . 72.51 111.007 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -68.33 -45.99 71.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.039 0.536 . . . . 74.11 109.87 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -67.91 -39.38 83.58 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.469 -0.787 . . . . 73.53 111.32 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.415 ' CZ ' HD13 ' A' ' 38' ' ' LEU . 1.2 t80 -68.47 -46.42 69.81 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.154 0.982 . . . . 71.1 109.531 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -60.94 -44.83 96.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.894 1.278 . . . . 73.41 111.036 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.3 -38.47 90.31 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.235 0.614 . . . . 74.42 111.083 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.571 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.85 -33.93 76.68 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.335 -0.848 . . . . 51.22 110.947 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.74 -35.82 75.31 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.944 -0.571 . . . . 73.14 110.994 174.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.07 -38.56 91.51 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 122.951 0.5 . . . . 71.11 110.981 176.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.24 -51.4 67.91 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 123.959 0.787 . . . . 74.3 109.943 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.63 -35.85 79.08 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.597 0.759 . . . . 62.41 111.537 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -69.05 -41.58 77.45 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.773 1.229 . . . . 53.42 110.358 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.08 -33.8 65.04 Favored Glycine 0 C--N 1.347 1.171 0 CA-C-N 115.109 -0.951 . . . . 61.12 112.224 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -62.69 -50.85 69.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.089 0.556 . . . . 52.12 111.408 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.543 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -71.98 -28.01 28.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 112.231 0.456 . . . . 70.53 112.231 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.435 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 39.5 tt0 -62.83 -36.72 84.13 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.668 0.747 . . . . 52.42 109.583 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -77.8 -39.13 44.9 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 114.359 -1.291 . . . . 74.52 110.698 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 15.1 m-30 -76.59 -3.52 38.06 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 124.309 1.044 . . . . 61.51 112.081 -177.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.4 p -56.04 -31.36 63.06 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 121.507 0.67 . . . . 70.34 109.765 171.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.21 104.64 16.56 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.438 -1.319 . . . . 73.41 107.438 166.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -22.43 64.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.417 0.687 . . . . 70.25 110.724 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.7 m -58.62 -39.4 80.36 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.305 1.042 . . . . 65.3 110.966 170.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.13 -41.38 97.23 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 124.151 0.98 . . . . 64.24 110.818 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 29.0 mt -58.78 -51.17 75.35 Favored 'Isoleucine or valine' 0 C--N 1.362 1.11 0 O-C-N 123.956 0.785 . . . . 65.22 109.402 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 48.3 t -55.67 -46.18 77.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.88 0.872 . . . . 62.41 111.522 178.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -59.32 -42.96 92.64 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.662 -1.154 . . . . 64.14 111.832 -176.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -24.89 27.48 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 119.305 -0.379 . . . . 73.34 110.513 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 16.5 tp -67.46 -39.27 85.32 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.493 0.717 . . . . 71.14 110.859 -172.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.8 t -65.81 -26.15 67.55 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 115.363 -0.835 . . . . 54.14 111.18 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.15 -3.99 30.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.157 0.983 . . . . 73.12 111.64 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 30.5 t -73.71 126.96 31.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.633 -0.506 . . . . 75.34 109.633 -175.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -86.4 -2.17 58.2 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.326 -0.852 . . . . 74.33 111.674 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -136.45 171.61 14.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.126 0.489 . . . . 72.5 109.941 174.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -83.56 -36.31 24.09 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.077 0.951 . . . . 70.35 110.599 -177.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.529 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.3 mp -80.01 127.87 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 108.858 -0.793 . . . . 74.21 108.858 -175.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 98' ' ' PHE . 39.1 mt -61.95 -43.65 98.4 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.829 0.823 . . . . 72.24 110.41 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.4 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 12.7 m-85 -105.58 45.31 0.98 Allowed 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.143 -1.39 . . . . 73.01 108.933 -177.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.15 -66.72 0.35 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 118.483 0.583 . . . . 72.52 110.35 -170.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 36.1 t70 -73.07 -41.04 64.55 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.713 0.633 . . . . 74.13 111.028 -176.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.42 -58.56 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 123.839 0.712 . . . . 75.4 110.902 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -74.95 -20.79 59.53 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.979 0.912 . . . . 61.33 111.274 -176.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -64.42 -37.12 86.42 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 108.936 -0.765 . . . . 74.3 108.936 167.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 61.1 mtpt -71.75 -37.01 70.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.2 0.6 . . . . 73.11 110.721 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.571 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -58.35 -47.44 83.78 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.938 -0.393 . . . . 74.14 109.938 171.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.796 ' HB2' HH12 ' A' ' 34' ' ' ARG . 35.1 t -66.55 -38.97 88.25 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.744 0.818 . . . . 75.44 111.362 -177.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.749 ' HA ' ' HE3' ' A' ' 110' ' ' LYS . 39.1 t70 -69.4 -55.46 10.28 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.007 0.923 . . . . 55.51 110.197 -175.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.44 -22.84 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-N 115.22 -0.9 . . . . 64.13 110.598 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.412 ' HH2' HG21 ' A' ' 124' ' ' VAL . 43.8 t-105 -70.56 -38.14 74.1 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 118.907 -0.568 . . . . 71.34 111.153 171.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' A' ' 107' ' ' ASP . 10.0 mtmp? -58.92 -47.3 85.49 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 118.536 0.607 . . . . 72.21 110.085 172.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 12.6 mm-40 -58.02 -49.87 75.37 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.329 1.018 . . . . 72.53 110.332 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.8 OUTLIER -54.75 -61.72 2.13 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 124.258 0.974 . . . . 54.32 109.727 176.521 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -53.47 -39.59 64.63 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.541 1.136 . . . . 65.55 112.091 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.56 -60.41 3.38 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.969 0.507 . . . . 71.24 111.125 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.547 HD11 HD13 ' A' ' 58' ' ' LEU . 4.1 pp -65.26 -37.16 86.36 Favored 'General case' 0 CA--C 1.559 1.297 0 CA-C-O 120.877 0.37 . . . . 51.43 111.492 -173.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.649 HD22 ' SD ' ' A' ' 122' ' ' MET . 95.1 mt -65.39 -49.11 70.52 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.185 0.994 . . . . 61.41 111.131 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -73.83 -40.06 63.6 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 112.454 0.538 . . . . 62.44 112.454 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 78.9 t -71.5 -53.56 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 122.582 0.353 . . . . 71.12 111.06 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -87.66 -57.68 2.85 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.079 0.466 . . . . 54.4 111.284 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.47 HE22 HD22 ' A' ' 58' ' ' LEU . 64.8 mt-30 -84.66 -13.2 52.2 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.348 -0.842 . . . . 65.03 111.336 -172.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 60.82 35.32 19.47 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 124.765 1.226 . . . . 74.23 112.016 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.649 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.4 mtp -78.06 112.77 27.76 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 115.262 -0.881 . . . . 75.33 109.952 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -81.78 105.56 1.55 Allowed 'Trans proline' 0 C--N 1.369 1.647 0 C-N-CA 122.703 2.269 . . . . 62.45 110.637 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.469 HG22 ' HD3' ' A' ' 126' ' ' PRO . 11.6 p -130.98 109.35 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-O 122.091 0.948 . . . . 65.14 110.626 -176.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.3 t -143.78 71.97 17.1 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 115.145 -0.934 . . . . 72.3 109.017 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.469 ' HD3' HG22 ' A' ' 124' ' ' VAL . 25.9 Cg_endo -91.51 -2.44 4.48 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.322 2.682 . . . . 71.12 113.751 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 40.7 pt -129.85 -155.29 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.189 0.995 . . . . 72.01 109.342 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.6 p -73.17 -155.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.728 0.811 . . . . 73.44 110.899 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -46.12 87.02 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.232 1.013 . . . . 64.51 109.185 170.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.33 -27.91 6.2 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.854 -0.612 . . . . 63.04 112.232 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.25 -42.55 54.91 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.446 -0.575 . . . . 54.52 109.446 172.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 14.5 m -63.23 -18.84 63.97 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.453 1.101 . . . . 71.04 112.366 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.406 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER -58.48 -30.73 67.21 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.201 1.4 . . . . 74.11 111.752 -173.968 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.42 -40.37 57.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.325 0.65 . . . . 40.21 111.282 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -64.24 -39.26 93.59 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.791 0.836 . . . . 71.31 110.668 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -52.16 -57.05 10.81 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 124.6 1.188 . . . . 75.21 110.881 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -69.25 -35.71 76.39 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 124.343 1.027 . . . . 71.35 113.542 -171.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -72.1 -37.56 69.53 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 118.558 0.617 . . . . 72.44 111.049 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -75.73 -36.35 59.95 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.417 0.627 . . . . 64.42 110.517 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 143' ' ' GLU . 14.2 t70 -62.18 -48.49 79.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.235 1.414 . . . . 75.33 109.838 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.479 ' HB2' HE22 ' A' ' 27' ' ' GLN . . . -74.86 -24.34 58.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.235 -1.348 . . . . 72.31 112.205 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.97 -45.76 93.46 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.861 -0.792 . . . . 44.24 108.861 168.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 140' ' ' ASP . 22.2 mm-40 -57.9 -54.16 50.08 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.182 -0.917 . . . . 75.04 111.291 175.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -62.09 -45.44 93.49 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 123.783 0.677 . . . . 72.54 112.5 -176.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -56.59 -54.3 47.53 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.768 0.827 . . . . 73.23 110.886 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -71.9 -30.22 65.14 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.834 -0.621 . . . . 62.32 111.308 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.47 -25.4 59.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.089 0.556 . . . . 72.02 110.957 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -57.8 3.59 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.263 0.625 . . . . 64.24 109.585 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.72 -52.14 64.42 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.352 -0.84 . . . . 64.22 110.65 -175.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 96.0 mmm -100.62 79.33 2.08 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.542 -1.281 . . . . 65.51 107.542 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.411 HD21 ' O ' ' A' ' 155' ' ' ASN . 31.5 tp -82.92 113.69 20.7 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.375 -0.829 . . . . 72.22 109.65 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.5 70.6 1.43 Allowed 'General case' 0 CA--C 1.551 1.001 0 CA-C-O 122.374 1.083 . . . . 65.42 108.937 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -159.74 60.26 0.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 114.934 -1.03 . . . . 73.31 108.34 176.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 56.74 26.92 11.96 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 114.621 -1.172 . . . . 74.41 112.237 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.411 ' O ' HD21 ' A' ' 151' ' ' LEU . 52.6 m-80 68.9 -74.7 0.08 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.548 1.539 . . . . 71.41 111.418 -173.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 118.08 -0.962 . . . . 73.02 110.035 -178.108 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.407 ' HG3' ' HB2' ' A' ' 4' ' ' LEU . 11.5 ttm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 121.233 0.54 . . . . 70.24 110.287 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -69.31 -32.6 71.82 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.536 0.735 . . . . 75.32 110.128 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -70.44 -55.47 8.93 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.701 -0.851 . . . . 73.21 108.701 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.407 ' HB2' ' HG3' ' A' ' 1' ' ' MET . 32.1 mt -60.07 -32.21 70.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.145 0.903 . . . . 72.23 112.153 177.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -61.48 -53.37 57.28 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 109.398 -0.593 . . . . 64.31 109.398 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -67.66 -36.45 80.75 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 123.828 0.705 . . . . 71.02 111.469 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.0 mt -56.89 -54.14 33.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.813 0.845 . . . . 54.14 110.843 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 42.1 mm -67.21 -38.97 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 115.085 -0.961 . . . . 70.23 110.94 -177.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.0 m -62.61 -47.39 83.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.279 0.632 . . . . 71.03 110.552 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.11 -60.63 3.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.659 0.783 . . . . 63.51 110.09 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.78 -41.22 95.85 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 124.515 1.134 . . . . 41.24 113.898 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 5.9 tp-100 -61.03 -56.15 24.36 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.649 -0.5 . . . . 73.54 109.649 178.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 85.3 t -62.98 -27.65 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 CA-C-N 115.263 -0.88 . . . . 75.13 111.393 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 69' ' ' LEU . 27.7 mt -60.93 -54.14 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.751 0.82 . . . . 64.44 109.618 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -58.15 -39.97 80.17 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 124.091 0.869 . . . . 74.11 110.508 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.436 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.4 mptm? -61.52 -51.43 68.65 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 123.826 0.704 . . . . 51.34 112.408 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 14.7 ptp180 -81.81 -15.71 53.27 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.411 0.523 . . . . 75.11 112.411 -176.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.619 ' SG ' HD23 ' A' ' 31' ' ' LEU . 45.4 t -69.69 -23.52 63.45 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.355 0.662 . . . . 71.24 110.829 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -65.17 -11.06 36.44 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.772 0.429 . . . . 72.51 112.127 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -30.58 71.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.47 0.708 . . . . 54.45 111.849 173.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.2 mmt -67.91 89.42 0.28 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.154 0.502 . . . . 65.44 111.401 -172.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.61 -20.26 61.32 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.709 -1.132 . . . . 74.1 110.574 169.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.6 m-85 -121.19 147.82 45.09 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.362 1.065 . . . . 63.35 108.396 177.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.615 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 96.8 m 59.09 59.06 2.88 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 124.812 1.32 . . . . 75.14 110.337 -166.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 26' ' ' LYS . 44.1 pttt -70.29 -40.14 74.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.174 -1.376 . . . . 72.14 111.782 -174.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 25' ' ' LYS . 60.1 tttm -78.02 -34.83 50.48 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.37 0.268 . . . . 73.15 110.305 -170.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -76.1 -25.48 55.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.339 0.656 . . . . 63.32 111.023 174.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 38.4 t -69.7 -44.27 70.73 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.743 0.817 . . . . 35.43 110.766 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.84 -33.3 70.52 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.635 0.774 . . . . 73.32 110.484 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.78 -44.33 93.71 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.56 0.744 . . . . 75.13 110.009 175.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.619 HD23 ' SG ' ' A' ' 18' ' ' CYS . 25.5 tp -59.1 -44.88 91.99 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 109.111 -0.699 . . . . 64.32 109.111 172.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.93 -47.53 88.32 Favored Glycine 0 C--N 1.353 1.486 0 O-C-N 124.148 0.905 . . . . 71.34 113.533 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -66.2 -39.68 89.83 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.181 0.592 . . . . 71.34 111.268 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.57 HH12 ' HB2' ' A' ' 106' ' ' SER . 36.5 mtt180 -61.3 -62.01 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.408 0.443 . . . . 72.04 110.478 174.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 64.9 t -53.88 -41.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.627 1.171 . . . . 45.44 112.225 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 39' ' ' ILE . 95.9 mt -68.64 -39.82 80.55 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.516 0.326 . . . . 73.42 110.611 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.07 -19.26 65.72 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-N 116.744 -0.207 . . . . 50.12 113.151 173.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 34' ' ' ARG . 5.2 mp -84.41 -53.53 5.39 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.452 1.101 . . . . 71.43 111.103 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 36' ' ' LEU . 15.2 pt -83.69 -42.81 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 118.404 -0.808 . . . . 70.52 112.328 -168.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 44' ' ' MET . 55.1 mtmt -52.41 -53.23 55.48 Favored Pre-proline 0 N--CA 1.49 1.552 0 CA-C-O 118.116 -0.945 . . . . 73.04 112.853 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.73 -43.22 51.85 Favored 'Trans proline' 0 C--N 1.398 3.146 0 C-N-CA 122.175 1.917 . . . . 74.44 111.7 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.15 -29.08 67.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.322 -0.853 . . . . 70.51 112.081 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 51.1 mt-10 -76.0 -38.06 57.76 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.661 0.785 . . . . 71.34 110.474 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 26.4 mmt -62.63 -36.31 82.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.596 -0.729 . . . . 74.5 110.111 177.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -80.6 -33.73 35.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.719 0.808 . . . . 70.3 111.042 176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.02 -32.93 74.7 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.563 1.145 . . . . 75.03 111.223 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -58.61 -42.13 87.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 124.046 0.842 . . . . 74.33 110.886 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.17 -43.98 69.7 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.619 -0.719 . . . . 55.24 109.721 171.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.47 -71.1 2.87 Favored Glycine 0 C--N 1.348 1.219 0 N-CA-C 111.065 -0.814 . . . . 51.4 111.065 -176.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? 69.94 141.53 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.696 1.598 . . . . 71.01 112.124 175.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.55 86.4 0.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.82 -0.807 . . . . 73.31 108.82 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 12.7 m -114.84 129.17 56.65 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 114.286 -1.325 . . . . 71.1 107.776 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 51.7 t -81.73 112.67 36.5 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 108.721 -0.844 . . . . 45.44 108.721 177.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -72.24 94.18 0.74 Allowed 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.568 2.178 . . . . 74.32 110.497 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.5 t -56.72 151.57 13.85 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.538 -0.756 . . . . 71.44 109.605 175.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.51 -39.47 83.95 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.083 0.553 . . . . 54.52 111.681 -174.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -71.41 -36.03 71.2 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.673 0.789 . . . . 74.21 111.807 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.54 -46.07 87.67 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.211 -1.033 . . . . 64.14 108.211 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.5 m -69.28 -40.27 77.84 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 114.348 -1.296 . . . . 74.44 110.873 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.6 m -60.32 -43.15 96.65 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.268 0.627 . . . . 70.23 110.811 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.64 88.97 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 123.778 0.673 . . . . 54.42 109.998 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.459 ' SD ' HD11 ' A' ' 112' ' ' LEU . 26.3 mmt -64.27 -25.07 67.89 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.266 -0.879 . . . . 74.23 112.362 176.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.54 -44.13 29.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.287 0.635 . . . . 73.31 110.693 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -59.18 -45.09 91.94 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.875 0.734 . . . . 74.45 109.401 175.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -61.18 -50.76 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 113.245 -1.798 . . . . 63.35 110.746 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -58.56 -48.65 80.22 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.939 1.296 . . . . 75.14 110.624 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.28 -39.39 93.84 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.351 0.661 . . . . 74.2 111.743 -177.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -69.72 -34.3 73.69 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.707 -0.679 . . . . 72.22 110.911 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.5 ' O ' HD11 ' A' ' 14' ' ' ILE . 89.8 mt -69.48 -34.09 73.84 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.732 0.413 . . . . 72.03 110.74 174.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.77 -40.57 97.0 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.834 0.35 . . . . 74.51 110.751 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.88 -39.97 87.67 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.67 -0.695 . . . . 65.21 111.175 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.26 -39.32 89.39 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.258 0.623 . . . . 75.42 110.998 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -62.43 -44.56 96.13 Favored 'General case' 0 C--N 1.351 0.65 0 O-C-N 124.565 1.166 . . . . 73.52 109.38 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.6 -36.8 93.82 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.781 -0.645 . . . . 72.52 112.957 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.34 -52.93 63.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.69 0.396 . . . . 74.01 110.884 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.409 HG23 ' CE2' ' A' ' 98' ' ' PHE . 0.3 OUTLIER -66.75 -26.48 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 112.73 0.641 . . . . 73.42 112.73 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.35 -36.02 82.32 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.087 0.47 . . . . 63.52 111.163 170.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -76.74 -38.56 54.0 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.733 0.813 . . . . 73.13 111.024 175.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.18 -0.86 37.92 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.871 0.868 . . . . 73.23 113.033 -173.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 p -58.2 -29.28 65.55 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.054 0.454 . . . . 33.31 110.608 169.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -82.29 110.35 17.38 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 115.086 -0.961 . . . . 51.13 108.76 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -69.85 -31.73 69.73 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.775 0.83 . . . . 75.54 111.122 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.0 p -67.73 -37.85 82.74 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.151 0.98 . . . . 52.12 111.18 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -61.76 -38.48 88.17 Favored 'General case' 0 C--O 1.25 1.114 0 C-N-CA 123.456 0.702 . . . . 75.25 111.05 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.496 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 22.6 mt -59.84 -49.7 82.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 CA-C-N 115.529 -0.759 . . . . 64.3 109.724 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.8 t -62.15 -35.06 77.63 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.222 0.609 . . . . 64.43 111.562 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -64.33 -47.72 78.31 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 124.055 0.847 . . . . 72.35 111.268 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.77 -32.44 59.94 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 110.002 -0.369 . . . . 71.44 110.002 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 9.7 tp -61.96 -50.62 71.39 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 124.184 0.994 . . . . 73.04 110.033 -174.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -61.23 -29.01 69.57 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 115.932 -0.576 . . . . 75.14 112.25 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.2 -54.48 6.44 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.355 0.662 . . . . 60.22 111.356 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -99.07 115.14 28.31 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.61 0.764 . . . . 74.44 109.622 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 145' ' ' ARG . 50.2 mt-30 -80.06 -46.48 16.46 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 112.88 0.696 . . . . 54.52 112.88 -170.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.17 -23.28 35.62 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.164 0.586 . . . . 71.41 111.098 -176.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -62.16 114.73 3.6 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 124.313 1.008 . . . . 73.32 110.841 -169.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.496 HG13 ' HB2' ' A' ' 141' ' ' ALA . 3.0 mp -61.71 157.39 3.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 CA-C-N 114.311 -1.313 . . . . 75.12 107.551 171.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -55.8 -31.4 62.61 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.855 0.862 . . . . 61.34 112.049 -173.539 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.415 ' CZ ' HD22 ' A' ' 31' ' ' LEU . 91.2 m-85 -125.57 25.54 6.97 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.107 -0.949 . . . . 71.11 110.694 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.28 -64.02 0.35 Allowed 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 125.488 1.515 . . . . 63.13 113.607 -163.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -67.31 -48.87 66.32 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.129 0.972 . . . . 73.52 111.553 -170.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.06 -43.38 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 114.765 -1.107 . . . . 65.44 110.875 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.519 ' HA ' ' HB2' ' A' ' 105' ' ' LEU . 67.3 t30 -78.34 -18.32 55.32 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.986 1.315 . . . . 73.35 110.212 -176.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.05 -39.78 72.07 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.746 -1.205 . . . . 61.43 107.746 168.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.73 -39.69 94.07 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.516 0.51 . . . . 72.41 110.523 170.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 102' ' ' ASN . 9.4 mp -60.07 -43.92 95.11 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 109.766 -0.457 . . . . 73.33 109.766 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.57 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.4 t -66.04 -47.5 74.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.116 0.566 . . . . 70.13 110.789 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.35 -57.35 7.65 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.642 1.177 . . . . 75.2 110.966 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.8 t -63.52 -39.85 86.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-N 115.566 -0.743 . . . . 72.04 111.258 -177.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.447 ' HE1' ' HG2' ' A' ' 126' ' ' PRO . 55.2 t-105 -69.37 -39.05 78.29 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-O 118.543 -0.741 . . . . 73.41 111.88 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -38.47 83.63 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 119.4 1.0 . . . . 72.42 110.534 175.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -60.5 -46.58 89.58 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.03 0.532 . . . . 73.25 110.903 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 8.4 tt -70.39 -48.2 57.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.595 1.158 . . . . 73.41 109.936 -172.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.1 p -65.63 -43.1 90.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.724 0.81 . . . . 73.0 110.891 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.7 mt -68.87 -35.33 76.77 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.234 -0.413 . . . . 72.42 112.041 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.67 -21.78 59.23 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-N 118.705 0.684 . . . . 75.43 110.896 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.0 mt -70.93 -35.33 72.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.916 -0.401 . . . . 65.24 109.916 167.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -29.81 65.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.73 0.812 . . . . 53.24 111.662 176.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 t -85.2 -62.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 122.728 0.411 . . . . 65.02 110.957 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -75.93 -56.14 4.95 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.203 0.601 . . . . 73.15 111.687 -170.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -85.12 -18.24 34.83 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.177 0.591 . . . . 74.12 110.808 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 61.52 16.22 7.41 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.63 1.572 . . . . 74.55 112.798 -177.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 36.6 mtm -71.84 140.83 83.94 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.522 -0.547 . . . . 73.32 109.522 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -81.0 35.65 0.59 Allowed 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 123.499 2.799 . . . . 51.42 112.813 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.9 t -91.08 93.06 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.397 -0.964 . . . . 74.23 108.397 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 23.0 t -158.65 77.37 3.27 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 123.304 0.641 . . . . 64.1 110.037 171.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.447 ' HG2' ' HE1' ' A' ' 109' ' ' TRP . 62.0 Cg_endo -85.36 38.42 0.64 Allowed 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 123.503 2.802 . . . . 71.05 112.086 173.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.406 HD12 ' CE3' ' A' ' 133' ' ' TRP . 12.7 tt -159.11 -50.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-N 115.827 -0.624 . . . . 70.41 110.604 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 66.2 m 46.49 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.657 1.583 . . . . 73.55 113.474 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.16 -40.91 67.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.347 0.659 . . . . 54.41 111.353 -175.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 81.0 -7.88 58.67 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.754 -0.47 . . . . 55.31 114.013 -176.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.39 -37.85 88.95 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.674 0.79 . . . . 64.21 110.868 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.436 ' O ' ' HG3' ' A' ' 136' ' ' GLU . 33.9 p -57.54 -55.62 32.53 Favored 'General case' 0 C--N 1.35 0.628 0 O-C-N 124.293 0.995 . . . . 72.34 110.25 173.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.406 ' CE3' HD12 ' A' ' 127' ' ' ILE . 5.9 m0 -53.96 -41.96 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.568 1.147 . . . . 74.3 113.077 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.44 -37.11 82.48 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 122.785 0.434 . . . . 44.34 111.877 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -74.58 -43.58 54.95 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.904 0.482 . . . . 74.14 111.269 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 132' ' ' SER . 44.7 mt-10 -63.07 -53.71 49.46 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.502 0.721 . . . . 61.4 110.976 -174.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.83 -29.73 68.46 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.541 0.737 . . . . 74.21 112.461 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -71.52 -45.25 62.9 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 123.757 0.661 . . . . 74.03 110.729 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -68.27 -35.75 78.37 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.026 -0.533 . . . . 73.31 110.548 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.47 -45.0 81.17 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.39 -0.823 . . . . 74.31 109.043 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.496 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -57.69 -40.89 80.47 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 124.272 0.982 . . . . 62.24 111.181 178.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.77 -60.6 3.27 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 124.084 0.865 . . . . 72.43 110.903 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.76 -46.73 86.8 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.261 1.024 . . . . 74.24 111.689 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -78.58 -27.22 45.64 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.185 -1.371 . . . . 64.42 110.84 -170.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.476 ' CZ ' ' HA ' ' A' ' 93' ' ' GLN . 57.0 ttt85 -61.68 -47.8 83.68 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 115.939 -0.573 . . . . 73.4 109.681 167.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -62.84 -37.3 86.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.766 0.666 . . . . 54.15 110.688 176.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.45 -20.91 62.86 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.779 0.675 . . . . 75.1 111.684 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.615 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -84.85 -62.45 1.54 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.804 0.275 . . . . 73.5 110.552 172.225 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -68.26 -24.3 64.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.432 1.093 . . . . 64.43 111.485 -166.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 44.0 ttm -139.57 83.22 1.92 Allowed 'General case' 0 C--O 1.24 0.554 0 N-CA-C 107.378 -1.342 . . . . 65.31 107.378 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 1.3 tt -70.57 82.94 0.6 Allowed 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.614 -0.721 . . . . 75.02 109.303 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -158.43 83.71 0.84 Allowed 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.771 -1.196 . . . . 75.32 107.771 -177.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -170.64 -46.53 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.415 -1.328 . . . . 55.13 107.415 -172.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -165.19 136.58 4.06 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 113.689 -1.596 . . . . 70.42 108.427 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -145.02 173.12 12.16 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.711 0.804 . . . . 74.03 109.909 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 . . . . . 0 CA--C 1.549 0.942 0 C-N-CA 123.822 0.849 . . . . 65.25 109.827 -176.74 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.2 ttp . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 110.622 -0.14 . . . . 72.45 110.622 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.47 -22.28 54.2 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.43 0.692 . . . . 63.11 111.559 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.19 -57.35 11.49 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.604 1.162 . . . . 64.44 108.776 171.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.94 -44.25 97.15 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 114.961 -1.018 . . . . 72.51 110.5 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -58.31 -51.19 70.84 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.571 0.545 . . . . 73.43 111.07 -175.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 22.0 m-70 -67.9 -52.1 40.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.032 0.533 . . . . 72.31 111.182 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.8 mt -53.61 -50.21 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 124.12 0.968 . . . . 74.52 111.86 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.455 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 99.6 mt -63.68 -46.44 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.545 -0.74 . . . . 74.32 109.667 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -51.63 -44.17 62.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 123.754 0.659 . . . . 52.21 110.571 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 84.6 mt -59.85 -50.9 71.99 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.729 0.643 . . . . 74.3 110.307 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.78 -33.82 87.0 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 124.385 1.053 . . . . 62.21 113.629 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 19.3 mm-40 -64.9 -52.79 54.59 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.668 -0.864 . . . . 71.54 108.668 176.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.71 -34.63 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.354 1.062 . . . . 53.44 110.946 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.71 -51.6 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 123.983 0.913 . . . . 74.24 109.736 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -64.06 -36.4 83.88 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.815 0.697 . . . . 73.54 110.346 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.1 mmmt -79.65 -29.05 40.84 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.352 0.661 . . . . 65.34 112.653 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 20' ' ' GLU . 11.6 ptm180 -87.98 -20.97 25.14 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.219 -0.301 . . . . 71.24 110.756 174.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 36.5 t -74.05 -20.26 60.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.781 0.832 . . . . 51.22 110.927 175.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -48.85 -36.43 16.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.832 0.853 . . . . 75.4 112.402 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HB2' ' NH2' ' A' ' 82' ' ' ARG . 12.8 pt-20 -76.83 -3.37 38.1 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.464 0.913 . . . . 75.13 113.464 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 18.6 mmt -74.98 83.91 2.25 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.64 -0.504 . . . . 63.22 109.64 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -70.1 -36.45 74.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.929 -0.767 . . . . 73.33 108.929 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -95.86 158.26 15.53 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.743 -1.117 . . . . 73.34 109.215 168.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.677 ' SG ' HG21 ' A' ' 85' ' ' ILE . 91.8 m 56.51 58.96 3.84 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 124.237 0.961 . . . . 74.44 109.934 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -70.53 -49.4 48.56 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 113.675 -1.602 . . . . 72.22 110.379 -171.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 52.4 mttm -70.58 -38.93 74.14 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.995 -174.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.27 -26.34 61.95 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.29 0.636 . . . . 74.11 111.337 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 49.7 t -69.46 -37.48 77.33 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.42 0.688 . . . . 74.54 110.311 170.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.89 -34.23 68.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.548 -0.751 . . . . 74.52 110.573 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 26' ' ' LYS . 29.0 mmt180 -69.2 -60.58 2.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.913 0.485 . . . . 73.2 109.985 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.7 tp -54.79 -49.35 71.16 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.857 0.723 . . . . 75.1 110.146 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.11 -55.48 30.09 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 124.059 0.849 . . . . 74.3 113.548 -176.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -67.94 -36.83 80.81 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.882 0.873 . . . . 74.43 110.996 -175.069 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.504 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 42.3 mtt-85 -63.42 -62.41 1.7 Allowed 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.822 0.701 . . . . 74.3 110.704 176.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 87.1 t -54.06 -46.76 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.041 0.936 . . . . 73.31 110.989 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.92 -38.43 90.96 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.228 -0.896 . . . . 54.54 109.708 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -75.71 -13.24 83.21 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 115.539 -0.755 . . . . 71.45 113.738 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 65.6 mt -84.09 -44.93 13.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.137 0.575 . . . . 75.24 110.003 174.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 pt -85.97 -24.43 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-N 115.498 -0.774 . . . . 71.4 112.407 -172.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -62.05 -47.28 91.1 Favored Pre-proline 0 N--CA 1.497 1.899 0 N-CA-C 112.899 0.703 . . . . 73.12 112.899 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.65 -51.48 11.02 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 121.758 1.639 . . . . 60.11 110.447 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.07 -19.61 64.89 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.296 -0.866 . . . . 52.24 111.772 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -68.1 -55.34 12.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.351 0.66 . . . . 63.2 110.013 174.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 50.7 mtm -64.65 -35.31 80.62 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.908 -1.042 . . . . 73.32 110.166 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 122' ' ' MET . 68.3 mt -82.02 -18.92 41.63 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.76 1.224 . . . . 74.32 111.838 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -75.43 -43.1 51.53 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.454 -0.572 . . . . 72.32 109.454 172.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -55.51 -45.28 77.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.788 -1.096 . . . . 65.42 110.231 177.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -78.26 -37.95 43.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.838 -1.074 . . . . 73.43 110.809 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.6 52.93 4.52 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.58 -0.736 . . . . 74.33 112.4 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -69.33 108.96 3.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.06 0.944 . . . . 73.22 110.264 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.6 mtm180 70.87 24.67 4.06 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 125.654 1.582 . . . . 74.22 112.009 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -61.4 129.56 41.81 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.658 0.383 . . . . 74.42 110.632 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 44.6 t -84.63 113.24 47.99 Favored Pre-proline 0 CA--C 1.55 0.971 0 O-C-N 124.241 0.963 . . . . 75.01 110.215 -177.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -82.22 151.0 15.69 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 123.189 2.592 . . . . 74.33 111.344 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.2 p -77.05 -179.73 5.74 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.979 0.512 . . . . 73.24 110.495 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.14 -34.48 68.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.193 0.597 . . . . 71.33 110.136 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -59.35 -51.49 69.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.819 0.848 . . . . 72.4 110.27 170.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.576 HD22 HD13 ' A' ' 115' ' ' LEU . 0.7 OUTLIER -54.96 -46.36 75.02 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.427 -1.26 . . . . 64.52 110.26 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 94.2 m -58.68 -46.83 86.37 Favored 'General case' 0 C--N 1.356 0.863 0 C-N-CA 124.025 0.93 . . . . 73.14 110.537 -178.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.1 m -61.88 -50.26 72.95 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.982 0.801 . . . . 71.12 110.352 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 64' ' ' ARG . . . -59.78 -40.47 88.35 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.949 0.899 . . . . 52.11 111.407 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.436 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.4 mmt -66.58 -35.59 80.59 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.481 -0.781 . . . . 75.11 110.842 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -71.7 -35.66 70.31 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.278 0.631 . . . . 62.22 111.039 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 61' ' ' ALA . 66.8 mtp85 -68.38 -41.13 81.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.072 0.949 . . . . 73.41 110.086 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.409 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 t80 -71.93 -41.2 68.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.64 -1.163 . . . . 73.25 110.023 -177.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 1.2 tmtp? -59.78 -48.35 82.02 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.092 1.357 . . . . 72.4 109.066 175.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -61.52 -40.66 95.44 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 124.538 1.149 . . . . 54.5 110.909 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.646 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -64.37 -36.1 83.04 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.698 0.799 . . . . 64.32 110.747 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -73.06 -27.69 61.88 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.282 0.633 . . . . 64.51 111.57 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 13.1 mm-40 -64.72 -41.55 95.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.338 -0.616 . . . . 75.54 109.338 172.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 5.0 mm-40 -59.48 -49.01 79.46 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-N 115.119 -0.946 . . . . 73.3 110.333 177.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.52 -47.48 85.38 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.957 0.786 . . . . 71.51 111.572 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.88 -48.75 80.3 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 124.4 1.063 . . . . 53.22 111.174 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.41 ' O ' ' HG2' ' A' ' 78' ' ' LYS . . . -61.35 -38.74 96.21 Favored Glycine 0 C--N 1.351 1.378 0 O-C-N 124.026 0.829 . . . . 31.41 112.815 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -62.89 -56.78 14.25 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 118.765 -0.636 . . . . 70.14 111.135 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.566 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.8 OUTLIER -63.49 -23.06 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 122.756 0.423 . . . . 75.23 112.053 177.76 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.47 -38.05 80.71 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.675 0.39 . . . . 63.32 110.262 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 74' ' ' GLY . 31.5 mmtp -83.9 -29.5 27.13 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.453 0.301 . . . . 70.44 111.129 176.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.566 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.8 m-85 -77.46 -8.52 57.88 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.319 1.048 . . . . 62.13 111.335 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.1 p -56.37 -30.41 62.64 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.214 0.606 . . . . 74.24 109.889 171.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -81.21 102.13 10.14 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.54 -1.281 . . . . 71.33 107.54 165.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.616 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.6 mpt_? -70.32 -24.89 63.09 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.749 0.82 . . . . 63.43 110.535 -175.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 72.4 p -66.89 -40.98 87.93 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.947 0.899 . . . . 44.33 110.478 172.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -57.86 -42.29 84.2 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.011 0.924 . . . . 74.12 110.65 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.677 HG21 ' SG ' ' A' ' 24' ' ' CYS . 15.7 mt -58.81 -57.45 11.16 Favored 'Isoleucine or valine' 0 C--N 1.356 0.889 0 CA-C-N 115.323 -0.853 . . . . 75.24 109.379 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.4 t -53.77 -37.09 63.08 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.766 0.827 . . . . 53.44 112.146 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -60.67 -45.71 93.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.832 1.253 . . . . 75.1 111.277 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -25.95 29.65 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.408 0.147 . . . . 70.11 110.78 176.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.464 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 13.4 tp -78.01 -29.21 49.42 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.572 0.749 . . . . 71.11 111.635 -167.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -72.76 -26.62 61.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.114 0.566 . . . . 71.41 110.214 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.13 -37.27 20.42 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.018 0.927 . . . . 74.14 110.369 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.581 ' HB2' ' HB2' ' A' ' 95' ' ' LYS . 79.2 p -79.13 133.73 36.73 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.108 0.563 . . . . 63.23 110.384 -178.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -94.97 -43.08 8.32 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.759 0.824 . . . . 64.51 110.853 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -146.7 11.19 1.09 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.51 0.724 . . . . 61.11 110.96 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.581 ' HB2' ' HB2' ' A' ' 92' ' ' SER . 99.4 mttt -67.16 89.03 0.18 Allowed 'General case' 0 C--N 1.354 0.761 0 N-CA-C 108.104 -1.073 . . . . 65.41 108.104 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.3 mm -57.28 137.87 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.923 -1.139 . . . . 64.1 107.923 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.3 mp -45.33 -38.52 5.84 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.198 0.999 . . . . 63.21 112.488 -177.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.44 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 61.4 m-85 -125.65 39.31 3.99 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 123.924 0.89 . . . . 65.52 109.797 -177.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 95' ' ' LYS . 21.9 pttp -56.55 -58.47 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.755 0.707 . . . . 74.04 111.399 -176.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.32 -47.89 53.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.523 1.129 . . . . 72.11 110.229 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.71 -63.53 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.605 0 O-C-N 124.372 1.045 . . . . 71.15 110.933 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.426 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 43.6 t30 -65.9 -28.03 68.64 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.774 1.23 . . . . 74.11 111.475 -176.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -57.66 -46.87 83.68 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 110.02 -0.363 . . . . 74.41 110.02 169.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -67.36 -32.55 73.56 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.189 0.596 . . . . 75.41 111.944 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -60.7 -47.92 84.09 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 110.012 -0.366 . . . . 72.41 110.012 171.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.7 m -68.46 -39.67 81.34 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.048 0.939 . . . . 44.04 111.323 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.536 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 9.5 t0 -68.0 -58.41 4.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.468 -1.242 . . . . 65.44 109.151 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.5 t -65.15 -33.93 67.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.449 -0.796 . . . . 73.12 110.348 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 49.3 t-105 -60.62 -44.09 96.73 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 119.187 -0.435 . . . . 74.53 111.479 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 19.1 pttm -64.61 -43.85 92.46 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.987 -0.745 . . . . 72.02 108.987 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.7 mt-10 -61.05 -42.57 98.73 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.696 0.799 . . . . 72.12 110.747 178.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.436 HD11 ' SD ' ' A' ' 62' ' ' MET . 7.0 tt -71.41 -48.47 49.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.966 1.306 . . . . 62.3 109.785 -171.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 39.3 t -61.0 -34.66 75.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.418 1.087 . . . . 74.21 110.922 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -63.9 -58.47 6.68 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 123.043 0.537 . . . . 75.4 111.502 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.576 HD13 HD22 ' A' ' 58' ' ' LEU . 2.0 pp -67.31 -20.26 65.58 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 118.569 0.622 . . . . 63.24 112.164 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.635 HD13 ' SD ' ' A' ' 122' ' ' MET . 46.7 mt -64.01 -55.27 23.54 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.747 0.419 . . . . 72.55 110.635 167.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.22 -26.49 62.96 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.052 0.389 . . . . 74.3 112.052 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 79.3 t -78.42 -54.33 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.418 0.687 . . . . 75.43 110.517 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -90.15 -59.14 2.27 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.075 0.398 . . . . 73.23 112.075 -172.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -77.25 -14.44 59.76 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 122.721 0.408 . . . . 74.3 110.944 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.14 54.69 6.61 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.904 1.281 . . . . 63.4 108.858 -175.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.635 ' SD ' HD13 ' A' ' 116' ' ' LEU . 51.0 ttm -92.24 131.0 35.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 108.414 -0.958 . . . . 71.3 108.414 174.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 2.7 Cg_exo -76.52 22.78 0.51 Allowed 'Trans proline' 0 C--N 1.371 1.753 0 C-N-CA 122.958 2.438 . . . . 74.41 113.61 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 13.9 p -76.04 109.5 9.91 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.541 0.736 . . . . 64.21 110.598 -175.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 66.7 m -151.46 76.07 7.71 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 107.702 -1.222 . . . . 72.04 107.702 166.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -82.52 -16.49 8.01 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 122.354 2.036 . . . . 71.13 111.714 175.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 11.4 tt -126.97 144.94 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.626 1.17 . . . . 44.25 109.329 -175.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 39.1 p -76.32 -61.91 1.79 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.57 0.748 . . . . 75.24 110.259 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -159.4 -12.26 0.06 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.352 0.661 . . . . 74.44 112.276 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.436 ' HA2' ' HB2' ' A' ' 133' ' ' TRP . . . 95.52 16.22 40.67 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-O 120.023 -0.32 . . . . 53.32 112.951 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.47 -52.06 55.7 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.791 0.837 . . . . 61.13 110.835 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.2 m -73.55 -30.86 63.32 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.242 -0.89 . . . . 62.44 110.787 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.436 ' HB2' ' HA2' ' A' ' 130' ' ' GLY . 0.1 OUTLIER -60.01 -43.61 95.1 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.185 0.994 . . . . 73.33 111.7 -179.175 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.11 -41.38 92.48 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.499 0.719 . . . . 72.33 111.216 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -72.03 -45.14 61.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.897 0.879 . . . . 71.5 111.464 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.441 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 19.0 mm-40 -50.1 -55.95 12.85 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.656 1.182 . . . . 64.12 111.449 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 -52.18 45.84 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 114.467 -1.242 . . . . 72.44 111.979 -174.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -60.74 -40.08 91.06 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 118.247 0.476 . . . . 74.42 111.289 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -53.16 19.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.409 0.684 . . . . 74.25 109.237 -177.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.89 -34.87 78.73 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.911 -1.04 . . . . 63.21 110.234 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.03 -31.93 66.64 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.103 0.961 . . . . 64.42 111.215 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -65.06 -47.26 77.97 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 123.738 0.649 . . . . 65.02 110.327 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.36 -33.8 75.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.768 -0.651 . . . . 71.12 111.593 174.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.7 t0 -72.58 -41.96 65.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.231 1.012 . . . . 71.24 111.521 -178.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.464 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 26.8 ttp85 -60.76 -43.23 98.27 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 114.855 -1.066 . . . . 74.41 109.128 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 13.7 ttp-105 -66.71 -33.92 76.7 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.972 -1.013 . . . . 74.41 111.548 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.4 -27.61 66.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.452 0.301 . . . . 53.43 111.101 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -47.64 10.57 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.198 0.599 . . . . 75.32 110.653 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -80.99 -41.63 22.44 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.67 0.788 . . . . 74.02 112.43 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 49.1 ttm -76.73 -61.0 2.11 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.515 -1.291 . . . . 74.34 107.515 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.462 ' HG ' ' H ' ' A' ' 153' ' ' ARG . 18.5 tp 65.01 163.66 0.15 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.705 1.202 . . . . 75.24 112.207 175.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 21.0 ttm-85 -160.64 33.88 0.16 Allowed 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.852 0.834 . . . . 73.12 109.24 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.462 ' H ' ' HG ' ' A' ' 151' ' ' LEU . 1.5 tpm_? -122.28 174.52 6.94 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.468 1.107 . . . . 74.34 109.123 -176.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -53.56 126.02 20.2 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.825 0.85 . . . . 74.31 111.866 -177.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -156.81 -166.27 2.06 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 124.182 0.993 . . . . 75.53 109.261 -170.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 . . . . . 0 CA--C 1.562 1.417 0 C-N-CA 123.289 0.636 . . . . 70.21 111.116 -179.843 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.551 ' HG3' ' H ' ' A' ' 2' ' ' GLU . 12.6 ptm . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 110.745 -0.095 . . . . 74.22 110.745 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.551 ' H ' ' HG3' ' A' ' 1' ' ' MET . 3.5 tm-20 -80.08 -48.06 13.84 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.2 -1.037 . . . . 75.01 108.2 -176.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.549 ' HA ' ' HD2' ' A' ' 66' ' ' LYS . 5.1 p30 -55.76 -43.99 77.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.471 -1.24 . . . . 61.52 111.14 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.455 ' O ' HG12 ' A' ' 8' ' ' ILE . 29.2 mt -65.55 -33.44 75.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.529 0.731 . . . . 72.41 111.789 175.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 tmtp? -60.7 -44.92 95.97 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 107.973 -1.121 . . . . 75.24 107.973 177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -68.72 -40.14 80.08 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.858 -0.61 . . . . 74.1 111.915 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.45 HD12 HD23 ' A' ' 4' ' ' LEU . 83.9 mt -58.9 -53.14 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.394 0.678 . . . . 51.33 110.612 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.756 HG23 ' HG2' ' A' ' 43' ' ' GLU . 30.6 mm -70.29 -53.68 22.0 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-N 115.413 -0.812 . . . . 71.04 110.806 -174.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 92.1 m -60.41 -58.96 6.27 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 123.834 0.709 . . . . 72.32 110.848 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 14' ' ' ILE . 95.0 mt -66.48 -32.41 73.76 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 118.644 -0.693 . . . . 73.5 111.748 -175.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -63.09 -43.01 99.39 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 121.387 -0.435 . . . . 65.31 112.473 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.02 -38.77 79.39 Favored 'General case' 0 CA--C 1.552 1.026 0 O-C-N 122.427 -0.455 . . . . 72.04 110.647 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.5 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 73.0 t -64.32 -34.85 71.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.554 0.742 . . . . 72.01 110.386 175.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.472 HG21 HG21 ' A' ' 35' ' ' VAL . 54.8 mt -56.85 -52.81 50.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.669 0.787 . . . . 71.32 109.152 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -58.96 -33.05 70.19 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 123.998 0.811 . . . . 74.12 111.522 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -67.48 -57.65 6.15 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.549 0.739 . . . . 55.2 112.023 176.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 15.0 ptp180 -82.53 -15.55 51.96 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 113.015 0.746 . . . . 75.13 113.015 -172.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.605 ' SG ' HD23 ' A' ' 31' ' ' LEU . 49.2 t -68.98 -28.37 66.55 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.097 0.408 . . . . 72.11 111.967 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -5.26 58.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.458 0.303 . . . . 65.14 111.71 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.86 -39.43 89.12 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 123.412 0.685 . . . . 53.11 109.608 172.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 80' ' ' SER . 3.3 mpp? -64.7 104.29 0.8 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.389 -0.823 . . . . 75.51 109.658 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -31.78 71.15 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.526 0.73 . . . . 75.55 109.398 172.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.483 ' O ' ' HB3' ' A' ' 21' ' ' MET . 87.2 m-85 -91.89 169.68 10.48 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.577 -1.192 . . . . 74.51 109.017 170.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.648 ' SG ' HG21 ' A' ' 85' ' ' ILE . 56.7 m 56.41 56.24 5.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.255 1.026 . . . . 63.53 110.204 -172.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.87 -47.13 66.68 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.564 -1.653 . . . . 73.12 109.961 -174.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.563 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.1 mtpm? -82.0 -17.72 45.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.889 -1.05 . . . . 74.52 109.824 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.667 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 10.7 mm-40 -70.62 -38.82 73.98 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 110.324 -0.25 . . . . 73.14 110.324 168.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.546 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 52.5 t -67.52 -32.92 74.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.843 0.715 . . . . 70.41 110.041 174.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -62.44 -62.98 1.38 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.772 0.429 . . . . 74.32 111.854 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.408 HH12 ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -60.6 -41.21 94.29 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.627 0.371 . . . . 75.44 111.875 -176.662 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.605 HD23 ' SG ' ' A' ' 18' ' ' CYS . 60.1 tp -65.24 -59.61 3.88 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.586 0.354 . . . . 60.42 110.074 179.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.48 -40.77 92.77 Favored Glycine 0 C--N 1.345 1.046 0 O-C-N 124.41 1.068 . . . . 70.51 113.459 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -65.69 -49.34 68.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.522 0.729 . . . . 55.44 111.102 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.547 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 55.3 mtt-85 -57.09 -58.41 8.31 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.859 0.725 . . . . 62.52 110.147 175.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.472 HG21 HG21 ' A' ' 14' ' ' ILE . 54.5 t -52.1 -45.99 42.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 124.048 0.939 . . . . 72.21 111.672 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.18 -45.75 93.32 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.438 0.461 . . . . 72.41 110.878 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.51 -24.45 69.4 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 123.164 0.29 . . . . 63.02 113.647 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.624 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 30.2 mt -85.86 -51.6 6.29 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 123.488 0.715 . . . . 73.54 111.401 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.441 HG21 ' HA3' ' A' ' 11' ' ' GLY . 17.0 pt -72.66 -40.81 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.422 -0.799 . . . . 74.25 111.214 -173.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 23.8 tptm -51.33 -50.54 75.53 Favored Pre-proline 0 N--CA 1.49 1.571 0 N-CA-C 113.778 1.029 . . . . 72.52 113.778 -170.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 51.0 Cg_exo -57.48 -41.57 70.49 Favored 'Trans proline' 0 C--N 1.387 2.595 0 C-N-CA 121.726 1.617 . . . . 62.34 112.569 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.98 -25.51 59.97 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.185 -0.916 . . . . 64.45 111.218 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.756 ' HG2' HG23 ' A' ' 8' ' ' ILE . 38.5 mt-10 -67.69 -44.03 78.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.034 0.934 . . . . 73.32 109.562 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.432 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 30.3 mmt -59.69 -47.35 85.97 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 124.701 1.25 . . . . 64.45 110.165 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.2 -30.92 63.85 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.716 0.806 . . . . 54.45 112.071 -177.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.53 -29.86 61.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.94 0.896 . . . . 74.25 109.679 177.048 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.04 -50.43 13.13 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.623 0.769 . . . . 74.35 109.94 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 44' ' ' MET . 30.6 mm-40 -63.05 -52.9 60.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.538 0.735 . . . . 73.32 109.708 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -101.53 -138.24 10.08 Favored Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.199 -0.76 . . . . 64.02 111.199 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.99 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.859 0.863 . . . . 73.11 109.312 176.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -74.56 117.25 16.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.235 -0.893 . . . . 71.12 109.904 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.437 ' OG ' HD12 ' A' ' 4' ' ' LEU . 3.2 m -76.69 155.73 33.11 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 123.311 0.644 . . . . 63.53 109.993 -179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.45 77.47 54.32 Favored Pre-proline 0 CA--C 1.557 1.216 0 N-CA-C 108.231 -1.026 . . . . 70.21 108.231 170.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.48 ' HA ' HD23 ' A' ' 58' ' ' LEU . 62.1 Cg_endo -97.88 160.64 0.87 Allowed 'Trans proline' 0 C--N 1.378 2.115 0 C-N-CA 123.144 2.563 . . . . 74.12 113.385 -175.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -77.58 173.93 11.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 162.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.13 -43.39 98.54 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.335 0.654 . . . . 74.11 110.485 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? -74.77 -21.97 59.03 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.831 -0.622 . . . . 73.33 112.147 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 115' ' ' LEU . 13.0 tp -81.22 -30.69 34.17 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.29 0.636 . . . . 72.21 110.316 174.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.8 m -63.45 -45.35 91.29 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.435 -0.95 . . . . 52.22 108.435 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.467 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 57.2 m -60.58 -44.25 96.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 124.401 1.063 . . . . 71.03 111.244 174.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.51 -42.99 98.46 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.6 0.76 . . . . 51.14 111.275 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.45 -30.67 69.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.164 0.586 . . . . 62.04 111.042 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -74.15 -32.92 63.33 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.133 0.573 . . . . 64.42 111.164 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.8 mtt180 -65.21 -47.1 78.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 109.143 -0.688 . . . . 73.33 109.143 175.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.624 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 4.5 t80 -65.51 -45.49 83.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.673 -1.603 . . . . 75.41 109.772 -175.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 34.4 tttm -49.67 -57.71 6.7 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 113.915 -1.493 . . . . 75.22 110.269 169.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -62.91 -31.47 72.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.704 0.802 . . . . 70.41 111.824 -176.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.589 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -70.0 -37.75 75.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.911 0.884 . . . . 73.21 111.164 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.03 -21.14 40.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.152 0.581 . . . . 75.52 110.541 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 78.1 mt-10 -72.55 -38.13 68.07 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.352 0.661 . . . . 61.13 110.05 171.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 48.3 mt-10 -64.67 -50.21 67.94 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.696 -0.684 . . . . 73.54 109.381 174.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -57.07 -48.18 79.2 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.279 0.987 . . . . 72.13 111.71 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -56.54 -42.73 78.98 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.436 1.085 . . . . 73.41 110.704 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.24 -36.49 89.84 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.646 0.592 . . . . 64.21 113.218 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.2 mm-40 -63.08 -55.51 24.83 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.941 -0.392 . . . . 71.32 109.941 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.3 pt -69.03 -20.18 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.366 0.666 . . . . 72.32 112.404 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -62.06 -46.66 88.15 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 122.973 0.509 . . . . 72.33 109.92 167.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -82.84 -24.33 33.35 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.349 0.5 . . . . 64.52 112.349 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.629 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.0 m-85 -81.18 -12.3 59.22 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.543 0.737 . . . . 74.42 111.239 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.611 ' HA ' ' SD ' ' A' ' 21' ' ' MET . 96.9 p -55.78 -28.71 57.49 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.669 0.606 . . . . 54.21 110.568 176.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.74 104.82 13.26 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.406 -1.331 . . . . 72.21 107.406 162.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -69.67 -23.73 63.5 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.728 0.811 . . . . 71.44 110.3 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -63.34 -35.87 81.81 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.16 -0.927 . . . . 74.5 111.884 174.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -58.55 -46.37 87.0 Favored 'General case' 0 C--O 1.256 1.44 0 C-N-CA 124.262 1.025 . . . . 75.53 109.795 175.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.648 HG21 ' SG ' ' A' ' 24' ' ' CYS . 30.7 mt -56.12 -57.43 8.56 Favored 'Isoleucine or valine' 0 C--N 1.356 0.877 0 CA-C-N 115.229 -0.896 . . . . 73.11 109.766 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.2 t -56.53 -34.9 67.48 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.358 1.036 . . . . 25.34 111.504 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -66.06 -45.37 81.57 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.529 0.732 . . . . 64.54 111.702 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.39 -22.81 32.64 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 121.122 -0.231 . . . . 74.41 110.418 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 tp -79.19 -29.44 42.9 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.934 0.894 . . . . 73.53 111.259 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -72.1 -17.2 62.0 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.84 -0.618 . . . . 61.32 110.873 176.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -121.49 16.43 11.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.66 1.184 . . . . 42.12 111.002 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.7 p -78.39 130.01 35.62 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 109.55 -0.537 . . . . 64.32 109.55 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -80.35 -11.04 59.75 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.284 0.634 . . . . 74.15 110.586 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -124.8 164.11 20.69 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.587 1.155 . . . . 74.33 110.019 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.11 -33.07 16.41 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.77 0.828 . . . . 72.12 110.18 176.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 96' ' ' ILE . 2.8 mp -80.88 122.73 36.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 C-N-CA 123.07 0.548 . . . . 63.22 109.561 -173.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.667 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 5.8 tp -68.14 -41.99 80.78 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.034 0.933 . . . . 72.33 110.849 -175.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.438 ' CD1' ' HB3' ' A' ' 97' ' ' LEU . 69.8 m-85 -106.49 36.86 2.47 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 114.046 -1.434 . . . . 75.25 109.889 -175.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.61 -58.52 5.63 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.78 0.832 . . . . 74.52 112.781 -175.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.7 -49.84 69.29 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.393 -0.821 . . . . 74.42 111.219 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.79 -43.69 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 123.4 0.68 . . . . 75.24 111.006 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.492 HD21 ' NH1' ' A' ' 34' ' ' ARG . 33.0 t30 -71.16 -28.05 63.98 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.193 0.997 . . . . 72.34 110.516 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.39 -35.03 79.72 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.845 -0.798 . . . . 74.13 108.845 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -64.55 -53.48 47.17 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 109.796 -0.446 . . . . 73.32 109.796 168.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.589 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.7 mp -52.07 -38.45 57.19 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.034 0.534 . . . . 70.45 111.348 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.0 t -74.48 -56.62 4.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.326 0.65 . . . . 71.22 110.471 -175.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -53.9 -55.21 28.98 Favored 'General case' 0 C--O 1.257 1.466 0 C-N-CA 124.547 1.139 . . . . 71.44 110.715 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.2 t -65.62 -50.26 72.69 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 CA-C-N 113.547 -1.661 . . . . 60.1 110.84 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.54 -37.39 85.93 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 118.687 0.676 . . . . 72.22 111.478 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -56.69 -60.3 3.76 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.541 0.525 . . . . 64.51 109.764 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.45 -42.29 70.43 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 124.028 0.83 . . . . 73.32 111.315 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.01 -58.48 4.85 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.192 1.397 . . . . 74.35 110.156 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.2 p -59.09 -41.16 87.41 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.594 0.757 . . . . 63.43 111.602 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.19 -46.29 84.57 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.094 0.557 . . . . 72.1 112.286 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.822 HD11 HD13 ' A' ' 58' ' ' LEU . 4.2 pp -72.4 -22.94 61.05 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 122.271 -0.268 . . . . 64.15 110.706 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 122' ' ' MET . 88.1 mt -72.79 -36.01 67.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.402 0.681 . . . . 71.43 110.616 171.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 18.9 mm-40 -60.81 -38.72 86.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 75.45 109.756 171.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 97.2 t -68.99 -60.49 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.085 0 C-N-CA 123.53 0.732 . . . . 61.34 111.558 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.16 -60.93 2.16 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.622 0.769 . . . . 70.15 111.358 -172.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -93.63 -2.63 53.81 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 114.935 -1.03 . . . . 62.41 111.2 -166.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.34 15.78 7.96 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.307 1.043 . . . . 73.21 110.72 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.606 ' HG2' HG23 ' A' ' 124' ' ' VAL . 40.2 ttm -66.61 116.84 38.59 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 123.814 0.846 . . . . 55.35 110.334 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -82.7 13.92 2.46 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 123.315 2.677 . . . . 65.52 113.231 -168.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.606 HG23 ' HG2' ' A' ' 122' ' ' MET . 45.2 t -74.24 108.69 5.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 C-N-CA 123.284 0.634 . . . . 73.43 110.13 -177.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.1 t -156.0 68.85 4.98 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 115.75 -0.659 . . . . 65.35 109.446 175.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.38 -24.32 10.81 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.234 1.956 . . . . 73.51 111.02 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 12.0 tt -80.88 -31.51 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 124.856 1.262 . . . . 54.44 110.33 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.2 m 60.04 -77.68 0.02 OUTLIER 'General case' 0 C--N 1.361 1.079 0 C-N-CA 125.361 1.464 . . . . 64.23 111.256 -172.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -48.13 2.94 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.675 0.79 . . . . 71.2 109.017 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.5 11.01 6.26 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 115.798 -0.637 . . . . 72.12 112.314 -167.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.51 98.69 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 123.748 0.819 . . . . 72.13 110.886 176.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 33.1 p -60.94 -46.3 91.26 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.111 -0.95 . . . . 70.22 110.378 174.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 12.2 m0 -62.18 -23.74 66.78 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.209 1.003 . . . . 65.52 113.006 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.0 -48.95 41.04 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-O 120.821 0.343 . . . . 74.2 110.828 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -70.05 -35.85 74.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.471 -0.786 . . . . 75.2 112.019 -178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -60.67 -49.14 78.7 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.409 0.683 . . . . 73.44 111.191 -177.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -73.93 -39.78 63.57 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.731 -0.668 . . . . 72.33 112.011 -175.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -58.28 -59.0 6.0 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.618 -0.512 . . . . 73.14 109.618 176.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -52.7 -61.75 2.09 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 124.603 1.189 . . . . 54.14 111.095 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -50.74 65.16 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.077 -0.965 . . . . 74.45 111.489 -168.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.467 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -73.17 -28.9 62.48 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.813 0.696 . . . . 25.04 112.507 -172.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.18 -47.09 68.88 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.784 -0.45 . . . . 71.43 109.784 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.43 -37.06 85.83 Favored 'General case' 0 N--CA 1.484 1.25 0 O-C-N 123.915 0.759 . . . . 75.42 111.828 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 25.4 t0 -78.36 -42.92 29.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.94 0.896 . . . . 43.33 110.923 -171.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -63.6 -40.62 97.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 108.338 -0.986 . . . . 71.11 108.338 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -60.0 -46.89 88.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.043 0.937 . . . . 71.24 110.859 175.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.38 -23.22 60.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.343 0.657 . . . . 74.21 111.632 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.448 ' HE2' ' HG ' ' A' ' 24' ' ' CYS . 0.8 OUTLIER -73.04 -57.13 4.25 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.171 0.588 . . . . 65.33 109.462 178.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -74.33 -47.29 35.48 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.341 -0.845 . . . . 74.03 110.599 -173.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 38.5 ttm -89.35 73.46 7.96 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 107.151 -1.425 . . . . 74.42 107.151 168.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 17.5 tp -84.0 66.31 9.13 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.069 -0.969 . . . . 72.02 109.8 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -102.19 -31.78 10.41 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.487 0.715 . . . . 75.13 110.476 -175.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -62.03 -65.67 0.65 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.366 0.666 . . . . 62.21 110.263 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -131.68 108.25 9.36 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 115.994 -0.548 . . . . 71.11 110.483 -169.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -139.02 76.05 1.55 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.46 1.104 . . . . 73.11 108.252 175.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 . . . . . 0 CA--C 1.558 1.268 0 C-N-CA 124.963 1.305 . . . . 53.41 111.089 -177.076 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptm . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.419 -0.324 . . . . 74.23 111.293 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 52.24 -75.67 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 126.762 2.025 . . . . 72.12 112.167 173.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -48.58 -45.17 37.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.027 1.331 . . . . 64.34 109.997 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.9 mt -57.37 -43.25 83.41 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.747 -1.115 . . . . 64.13 111.949 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -59.13 -46.68 87.73 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.565 0.541 . . . . 71.12 110.16 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -62.6 -43.55 98.53 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.927 -0.578 . . . . 62.42 111.618 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.78 -48.77 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 124.3 1.04 . . . . 73.24 110.96 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.7 mt -62.68 -42.25 95.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 CA-C-N 114.602 -1.181 . . . . 75.44 111.151 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 13' ' ' VAL . 96.5 m -61.02 -50.56 72.87 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.368 0.667 . . . . 70.41 110.252 178.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.2 -42.23 94.64 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.6 0.76 . . . . 71.24 111.019 -177.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.12 99.7 Favored Glycine 0 C--N 1.349 1.254 0 O-C-N 123.618 0.574 . . . . 60.43 112.887 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.35 -43.03 92.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 122.268 0.227 . . . . 54.43 111.242 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 9' ' ' THR . 86.2 t -61.71 -35.32 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.637 0.775 . . . . 73.34 110.526 177.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -59.88 -61.02 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.326 1.05 . . . . 70.2 110.439 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.9 -33.12 73.65 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 123.644 0.59 . . . . 74.41 111.187 -175.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -62.21 -60.73 3.16 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.267 1.027 . . . . 72.0 110.825 177.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -78.57 -17.18 56.51 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.134 0.573 . . . . 73.44 112.514 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.5 t -60.95 -16.75 46.25 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.22 1.008 . . . . 61.52 111.49 175.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -58.39 -16.27 14.05 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.61 0.764 . . . . 71.54 112.685 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -62.3 -30.73 71.35 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.613 0.765 . . . . 74.25 111.818 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.5 mmt -67.85 90.38 0.29 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 120.909 0.385 . . . . 63.52 110.264 -175.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.75 -49.43 53.13 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 107.806 -1.183 . . . . 73.32 107.806 173.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -93.63 -179.51 5.04 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.53 -1.668 . . . . 73.13 109.721 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.592 ' SG ' HG21 ' A' ' 85' ' ' ILE . 34.1 m 53.01 56.24 7.83 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-O 122.199 1.0 . . . . 74.22 110.008 -167.502 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.87 -49.83 41.83 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 113.109 -1.86 . . . . 73.15 110.624 -169.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.1 -39.77 63.16 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.807 -1.088 . . . . 73.53 108.975 -174.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.451 ' NE2' ' H ' ' A' ' 97' ' ' LEU . 69.8 mt-30 -65.12 -27.01 68.44 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.31 0.644 . . . . 63.35 112.031 173.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.3 t -77.24 -35.33 55.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 122.605 0.362 . . . . 53.14 110.656 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -70.07 -33.4 71.86 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 116.412 -0.358 . . . . 61.22 110.416 172.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.488 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -67.94 -58.18 4.97 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.62 0.768 . . . . 74.14 109.822 179.699 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.97 -44.91 83.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.417 1.087 . . . . 73.4 110.359 178.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.58 -49.61 72.19 Favored Glycine 0 C--N 1.346 1.139 0 O-C-N 124.064 0.852 . . . . 41.0 112.87 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -65.9 -38.01 87.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.874 0.47 . . . . 70.32 111.399 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.436 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 83.3 mtt-85 -60.0 -53.59 56.08 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.059 0.543 . . . . 71.14 110.672 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 39' ' ' ILE . 61.9 t -59.5 -50.49 79.72 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.425 0 O-C-N 124.25 0.968 . . . . 51.34 110.846 -177.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.52 -46.49 85.79 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.6 0.563 . . . . 74.22 111.426 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.52 -19.15 74.36 Favored Glycine 0 N--CA 1.468 0.828 0 O-C-N 123.303 0.377 . . . . 53.31 113.367 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -86.64 -48.16 8.55 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.658 0.783 . . . . 64.45 111.663 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 35' ' ' VAL . 14.0 pt -79.54 -34.73 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 119.366 -0.35 . . . . 64.14 111.373 -173.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 44' ' ' MET . 87.5 tttt -57.33 -51.84 78.67 Favored Pre-proline 0 N--CA 1.488 1.449 0 N-CA-C 113.843 1.053 . . . . 73.53 113.843 -174.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.477 ' HB2' HG13 ' A' ' 124' ' ' VAL . 30.2 Cg_endo -60.32 -31.78 93.28 Favored 'Trans proline' 0 C--N 1.386 2.542 0 C-N-CA 121.573 1.515 . . . . 51.01 112.042 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.69 -40.99 72.58 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.169 0.588 . . . . 65.31 110.52 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.64 -37.36 83.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.568 0.747 . . . . 60.24 111.016 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -59.0 -55.05 40.21 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.909 0.756 . . . . 74.32 111.173 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 pp -77.42 -33.68 54.88 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.519 -0.764 . . . . 55.52 112.355 -175.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.81 -43.54 62.58 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.311 0.644 . . . . 74.05 110.066 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.12 -41.39 94.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.994 0.518 . . . . 75.44 110.377 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -63.95 -38.23 90.34 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.099 -0.955 . . . . 71.13 110.913 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -166.49 113.25 0.54 Allowed Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.846 -0.902 . . . . 23.42 110.846 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -77.24 4.51 10.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.274 0.63 . . . . 73.44 111.054 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.6 mmm180 -64.04 118.65 8.8 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.759 0.824 . . . . 65.51 110.872 -177.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 15.1 m -146.83 144.63 29.46 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 124.127 0.971 . . . . 54.34 108.404 177.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.408 ' H ' HE22 ' A' ' 120' ' ' GLN . 52.4 t -90.4 104.31 8.64 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 107.448 -1.316 . . . . 73.4 107.448 166.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.548 ' HA ' HD12 ' A' ' 58' ' ' LEU . 5.4 Cg_exo -79.25 86.85 1.62 Allowed 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 122.204 1.936 . . . . 45.14 110.471 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.6 p -76.59 177.22 7.65 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 115.648 -0.706 . . . . 72.41 109.302 171.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -58.95 -58.67 7.64 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.195 0.598 . . . . 72.43 111.044 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.9 -18.61 60.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.345 0.498 . . . . 64.15 112.345 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.548 HD12 ' HA ' ' A' ' 54' ' ' PRO . 3.5 tm? -65.9 -56.19 13.08 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 108.085 -1.079 . . . . 64.44 108.085 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 m -62.21 -39.73 93.74 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.071 -0.968 . . . . 72.12 110.824 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 88.5 m -61.44 -44.81 96.47 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.542 0.737 . . . . 73.43 111.36 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.85 86.08 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.142 0.577 . . . . 63.14 110.772 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.83 -27.82 68.53 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.746 0.654 . . . . 61.51 111.037 176.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -75.0 -41.27 59.8 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.144 0.577 . . . . 63.32 110.463 176.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 60' ' ' THR . 87.8 mtt180 -62.2 -40.55 96.44 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.31 0.576 . . . . 73.34 110.161 174.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.6 OUTLIER -65.88 -56.75 10.21 Favored 'General case' 0 C--O 1.216 -0.666 0 CA-C-N 114.422 -1.263 . . . . 75.33 109.277 -177.45 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.0 tmtt? -55.04 -41.28 71.21 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.876 1.27 . . . . 64.1 110.713 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.08 97.78 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.357 0.663 . . . . 60.42 111.296 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.544 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -67.4 -39.48 85.57 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.614 0.766 . . . . 64.22 111.156 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.422 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.4 mm? -67.02 -32.31 73.45 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.539 0.736 . . . . 74.31 111.002 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.8 mt-10 -68.08 -40.64 82.64 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.138 0.575 . . . . 72.25 111.288 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.9 mt-10 -67.92 -38.75 83.3 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.167 0.587 . . . . 72.22 110.11 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.469 ' HA ' ' HE2' ' A' ' 98' ' ' PHE . . . -64.71 -45.85 84.82 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.113 0.565 . . . . 71.35 110.603 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -59.51 -38.97 82.33 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 124.675 1.19 . . . . 63.23 110.561 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.3 -40.36 80.89 Favored Glycine 0 C--N 1.344 0.996 0 CA-C-N 114.894 -1.048 . . . . 75.52 112.472 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 24.0 mm-40 -68.07 -45.23 74.41 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.976 -0.535 . . . . 74.34 111.208 -178.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.603 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.7 OUTLIER -68.02 -26.39 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 CA-C-N 118.525 0.602 . . . . 63.24 111.544 175.703 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.76 -35.06 79.87 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.031 0.443 . . . . 64.3 110.315 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -76.43 -38.39 55.58 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.264 0.626 . . . . 63.43 110.847 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -75.01 -7.41 53.57 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.906 0.882 . . . . 65.43 112.596 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.4 p -57.72 -33.09 68.05 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.18 0.514 . . . . 71.22 110.308 176.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.05 109.81 5.35 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 107.721 -1.214 . . . . 73.33 107.721 164.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -67.57 -30.21 69.77 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 123.563 0.745 . . . . 64.13 111.022 -170.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -72.99 -27.17 61.64 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.153 -0.93 . . . . 60.5 111.67 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -60.85 -40.98 94.96 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 123.794 0.838 . . . . 53.24 110.866 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.592 HG21 ' SG ' ' A' ' 24' ' ' CYS . 16.0 mt -61.06 -55.3 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.165 -0.925 . . . . 74.12 109.252 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.1 -31.07 68.59 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.455 0.702 . . . . 72.55 111.607 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -63.17 -47.62 81.87 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.335 1.054 . . . . 50.44 111.321 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -29.84 43.1 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 120.243 -0.583 . . . . 72.02 110.285 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.44 ' HA ' ' HB3' ' A' ' 92' ' ' SER . 6.8 tp -74.49 -27.0 60.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.682 0.793 . . . . 44.12 111.512 -169.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -71.88 -22.1 61.56 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.947 0.499 . . . . 43.53 110.842 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.44 -35.72 13.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.901 0.88 . . . . 72.44 110.145 174.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.44 ' HB3' ' HA ' ' A' ' 89' ' ' LEU . 32.1 t -71.61 131.74 43.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.116 0.967 . . . . 62.33 110.974 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -96.45 -47.33 6.01 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.707 0.803 . . . . 74.11 110.318 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -149.46 13.68 0.85 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 75.45 110.317 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -70.54 101.02 1.91 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 106.854 -1.536 . . . . 55.34 106.854 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 12.4 mm -58.22 150.99 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.324 1.049 . . . . 73.34 110.103 -169.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.451 ' H ' ' NE2' ' A' ' 27' ' ' GLN . 5.4 tp -49.47 -40.58 37.6 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.389 0.676 . . . . 63.42 111.529 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.603 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 36.1 m-85 -124.38 42.42 3.26 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.681 -1.145 . . . . 74.34 109.993 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -49.87 -66.1 0.45 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.556 0.743 . . . . 73.14 110.461 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.18 -46.78 72.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.088 0.868 . . . . 65.12 111.293 -175.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.8 t -67.58 -55.97 15.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.582 -0.736 . . . . 72.45 111.315 -172.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.534 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 13.8 t30 -63.38 -28.41 69.97 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.999 0.92 . . . . 74.1 111.012 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -61.57 -42.85 99.45 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 110.146 -0.316 . . . . 72.22 110.146 170.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -59.45 -48.44 81.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 123.351 0.407 . . . . 74.11 110.764 173.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.544 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.0 mp -55.52 -41.63 73.39 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.537 0.335 . . . . 73.33 110.465 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.1 t -64.83 -52.92 54.13 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.151 0.98 . . . . 73.23 111.012 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.7 m-20 -65.76 -46.55 78.4 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.672 0.789 . . . . 75.23 111.787 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 85.2 t -66.99 -35.9 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 122.714 0.406 . . . . 65.31 110.545 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.521 ' HH2' HG12 ' A' ' 124' ' ' VAL . 21.4 t-105 -62.74 -41.57 99.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.706 0.402 . . . . 71.53 110.8 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtpt -56.33 -56.16 24.5 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 123.465 0.478 . . . . 75.13 109.746 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.55 -38.97 72.62 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.217 1.007 . . . . 62.41 111.331 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.0 OUTLIER -66.14 -59.62 3.59 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.237 0.961 . . . . 72.4 109.072 -173.729 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -59.06 -33.2 70.5 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.07 0.948 . . . . 70.51 111.195 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.468 ' O ' HG23 ' A' ' 118' ' ' VAL . 70.8 mt -60.55 -63.85 1.16 Allowed 'General case' 0 C--N 1.358 0.946 0 O-C-N 123.752 0.657 . . . . 64.24 111.193 173.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.02 -29.86 71.15 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.34 0.496 . . . . 71.23 112.34 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 88.4 mt -66.78 -45.42 78.5 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.854 0.862 . . . . 73.52 110.603 175.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 114' ' ' LEU . 11.5 pt20 -76.97 -20.29 56.27 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.079 0.152 . . . . 62.42 111.365 -179.288 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 114' ' ' LEU . 54.7 t -71.72 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 123.342 0.657 . . . . 65.04 110.749 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -89.96 -58.48 2.49 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.324 0.583 . . . . 74.42 111.781 -175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.408 HE22 ' H ' ' A' ' 53' ' ' VAL . 15.3 mm-40 -77.8 -12.86 60.01 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.137 -0.938 . . . . 75.15 110.855 -170.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.456 ' O ' ' HD3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER 64.17 18.13 11.08 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.341 1.457 . . . . 72.53 110.787 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 87.9 mtp -64.12 112.66 8.02 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.498 0.719 . . . . 71.52 110.038 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -87.03 41.22 0.73 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 123.821 3.014 . . . . 71.12 110.753 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.523 HG23 ' HB3' ' A' ' 122' ' ' MET . 20.1 t -88.11 87.78 2.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 114.629 -1.169 . . . . 72.03 108.76 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.9 t -164.07 69.44 1.62 Allowed Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 114.307 -1.315 . . . . 62.35 108.177 171.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -76.8 3.84 6.18 Favored 'Trans proline' 0 C--N 1.387 2.559 0 C-N-CA 122.884 2.39 . . . . 73.14 112.334 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 20.4 tt -116.24 -10.11 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 124.668 1.187 . . . . 74.14 110.231 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.9 t 64.83 -152.34 0.28 Allowed 'General case' 0 C--N 1.36 1.063 0 C-N-CA 124.596 1.158 . . . . 72.42 109.328 -174.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -58.51 -29.58 66.39 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.415 0.686 . . . . 73.04 111.907 174.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 133' ' ' TRP . . . 73.53 53.95 7.08 Favored Glycine 0 C--N 1.353 1.476 0 O-C-N 123.624 0.578 . . . . 73.32 112.211 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -64.12 -26.8 68.7 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.433 0.693 . . . . 74.52 111.333 176.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 63.2 p -63.1 -37.87 88.92 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.099 -0.955 . . . . 72.25 111.193 174.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.47 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 0.6 OUTLIER -50.2 -45.66 53.87 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.593 1.157 . . . . 72.3 113.091 -174.828 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.78 -36.03 79.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.009 0.523 . . . . 52.31 111.577 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -74.75 -36.27 62.59 Favored 'General case' 0 C--O 1.257 1.452 0 C-N-CA 123.301 0.64 . . . . 64.42 110.313 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 37.7 mt-10 -58.16 -62.5 1.78 Allowed 'General case' 0 C--N 1.355 0.818 0 CA-C-N 114.338 -1.301 . . . . 75.41 109.184 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -52.57 -37.06 57.16 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.041 0.838 . . . . 74.12 112.748 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -63.4 -60.63 3.12 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.267 0.354 . . . . 73.41 110.571 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -64.29 -36.33 83.75 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.456 1.122 . . . . 73.43 110.0 -176.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.67 -63.63 1.02 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 113.493 -1.685 . . . . 61.25 110.32 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 145' ' ' ARG . . . -63.83 -25.23 68.08 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 124.372 1.045 . . . . 60.32 111.564 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 17.4 t70 -60.42 -63.5 1.28 Allowed 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.526 -0.546 . . . . 72.2 109.526 175.318 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.8 -32.0 73.48 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 123.694 0.621 . . . . 63.22 112.116 -177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -71.65 -35.79 70.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.083 0.553 . . . . 74.03 110.644 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 141' ' ' ALA . 3.9 tmt_? -67.0 -39.78 87.19 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.929 0.892 . . . . 65.22 109.216 174.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 12.2 mmt180 -61.34 -48.77 79.81 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.508 0.505 . . . . 75.41 110.0 177.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.32 69.82 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.436 0.695 . . . . 63.31 111.993 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.86 -58.89 3.07 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.569 0.543 . . . . 74.22 110.275 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -75.2 -53.13 9.34 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.324 0.65 . . . . 63.22 111.313 -170.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.8 ttm -86.14 71.22 10.58 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.057 -1.46 . . . . 51.12 107.057 167.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.6 tp -74.75 107.86 7.12 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.196 -0.911 . . . . 73.04 108.901 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.31 -56.83 0.25 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 106.709 -1.589 . . . . 73.53 106.709 -173.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -89.55 85.21 6.44 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.006 -0.997 . . . . 74.33 108.545 176.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 30.3 t70 170.99 -65.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.369 1.867 . . . . 72.54 106.97 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -155.79 164.01 39.1 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.661 -1.154 . . . . 73.01 108.203 175.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 . . . . . 0 CA--C 1.554 1.114 0 C-N-CA 123.437 0.695 . . . . 75.11 109.448 177.441 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.5 ttp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 120.247 0.07 . . . . 75.4 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -61.39 -30.66 70.69 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.64 1.176 . . . . 74.22 111.317 -175.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -60.86 -53.86 52.2 Favored 'General case' 0 N--CA 1.482 1.142 0 O-C-N 123.759 0.662 . . . . 61.31 109.51 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' HG12 ' A' ' 8' ' ' ILE . 52.8 mt -65.84 -36.53 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.587 -1.188 . . . . 74.03 111.29 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -58.95 -48.17 82.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.542 -0.91 . . . . 72.41 108.542 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -70.21 -42.29 72.51 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-N 115.923 -0.58 . . . . 72.01 111.961 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.4 mt -56.62 -46.26 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.265 0.555 . . . . 62.24 110.892 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 4' ' ' LEU . 35.3 mm -72.72 -42.32 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.397 -0.819 . . . . 64.35 111.023 -176.114 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' HG23 ' A' ' 13' ' ' VAL . 86.6 m -64.34 -53.99 39.96 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.351 0.261 . . . . 73.11 110.453 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.9 mt -57.02 -51.5 69.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.925 0.89 . . . . 53.13 111.263 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.426 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -64.59 -32.04 82.88 Favored Glycine 0 C--N 1.344 1.021 0 O-C-N 123.907 0.755 . . . . 51.24 113.714 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.5 -44.99 56.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 122.689 -0.301 . . . . 74.34 110.632 176.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 75.3 t -59.31 -35.89 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.309 0.643 . . . . 75.22 109.893 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.573 HG21 HG21 ' A' ' 35' ' ' VAL . 29.6 mt -57.5 -54.36 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.464 1.105 . . . . 72.12 109.882 171.726 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -53.85 -34.93 60.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.941 0.896 . . . . 64.34 111.463 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -77.45 -47.22 20.27 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 112.266 0.469 . . . . 73.11 112.266 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.3 ptp180 -83.76 -17.24 41.83 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 112.851 0.686 . . . . 72.31 112.851 -173.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.08 -24.87 67.58 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.035 0.534 . . . . 53.15 111.671 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.8 -7.16 49.36 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.146 0.424 . . . . 74.54 112.146 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -61.14 -21.6 63.9 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.485 0.714 . . . . 74.01 111.612 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 21.6 mmt -67.78 88.57 0.25 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 124.013 0.821 . . . . 74.51 109.891 176.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.478 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 0.2 OUTLIER -69.93 -30.73 68.19 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.462 0.649 . . . . 71.24 109.901 170.343 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' MET . 53.0 m-85 -106.44 172.87 6.58 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.256 1.022 . . . . 74.52 108.472 167.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.548 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 66.4 m 58.95 73.91 0.46 Allowed 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.456 0.646 . . . . 75.34 110.705 -170.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.99 -59.49 2.88 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.715 1.206 . . . . 73.3 110.665 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 45.8 mmtm -68.33 -29.07 67.73 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 114.439 -1.255 . . . . 71.33 110.323 -175.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.433 ' HG2' ' CB ' ' A' ' 97' ' ' LEU . 0.3 OUTLIER -71.88 -40.18 69.11 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 123.611 0.569 . . . . 64.14 111.562 177.275 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.53 -41.32 97.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.315 0.578 . . . . 75.35 109.831 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -77.27 -24.14 51.08 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.093 -0.958 . . . . 63.2 111.487 176.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 137' ' ' ASP . 0.1 OUTLIER -70.13 -57.82 4.51 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 122.077 0.941 . . . . 74.11 109.803 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.94 -44.97 91.21 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.115 -1.857 . . . . 75.11 108.86 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.58 -53.2 48.0 Favored Glycine 0 C--N 1.353 1.477 0 O-C-N 123.877 0.736 . . . . 63.34 113.625 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -63.29 -45.44 91.43 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.219 0.607 . . . . 72.4 111.342 -175.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.616 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.6 mtt-85 -58.35 -58.03 10.31 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 123.763 0.664 . . . . 73.13 110.913 178.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 14' ' ' ILE . 79.2 t -56.94 -40.21 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.564 0.54 . . . . 75.52 111.358 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.411 HD23 HD11 ' A' ' 39' ' ' ILE . 71.7 mt -61.32 -48.39 81.56 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.589 0.356 . . . . 74.42 111.765 174.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.14 -21.44 61.68 Favored Glycine 0 N--CA 1.47 0.956 0 CA-C-N 116.613 -0.267 . . . . 74.23 113.202 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 61.7 mt -87.02 -52.19 5.58 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.383 0.673 . . . . 73.25 112.442 175.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 24.1 pt -74.23 -42.74 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 118.63 -0.7 . . . . 62.11 111.766 -169.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' MET . 53.2 mtmt -56.43 -51.49 80.59 Favored Pre-proline 0 N--CA 1.489 1.483 0 CA-C-O 118.071 -0.966 . . . . 70.51 112.786 -173.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 40' ' ' LYS . 77.8 Cg_exo -51.89 -45.64 37.25 Favored 'Trans proline' 0 C--N 1.4 3.249 0 C-N-CA 122.295 1.997 . . . . 75.02 112.334 174.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.464 HD13 HD21 ' A' ' 45' ' ' LEU . 4.5 mm? -66.39 -33.03 74.79 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.017 -0.992 . . . . 52.42 111.563 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 49.7 mt-10 -70.55 -35.17 72.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.403 0.681 . . . . 63.22 110.401 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -67.93 -47.13 69.57 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.477 0.485 . . . . 65.22 110.498 -178.275 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.464 HD21 HD13 ' A' ' 42' ' ' LEU . 4.2 pp -75.16 -30.87 60.87 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.744 0.418 . . . . 62.4 111.739 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -70.87 -35.43 72.37 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.325 0.65 . . . . 72.52 110.703 175.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.49 -55.2 22.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.177 0.591 . . . . 61.31 110.715 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -80.47 -19.31 46.28 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.532 -0.758 . . . . 65.54 111.826 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.6 170.25 24.1 Favored Glycine 0 C--N 1.349 1.29 0 C-N-CA 122.989 0.328 . . . . 61.2 112.721 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -165.72 -61.12 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.621 0.768 . . . . 50.23 110.226 -176.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -89.45 26.13 1.77 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.948 0.899 . . . . 75.42 110.792 -174.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 15.1 m -61.08 143.33 55.63 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 124.574 1.15 . . . . 73.4 110.342 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.4 t -108.14 102.35 45.81 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 123.526 0.73 . . . . 61.34 109.142 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -85.01 -158.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.353 2.702 . . . . 52.32 110.885 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 t -160.11 -177.44 6.29 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.182 0.593 . . . . 74.33 110.119 -175.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.8 -57.05 13.34 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.078 0.951 . . . . 72.34 111.55 -174.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -70.81 -23.64 62.4 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.816 0.446 . . . . 63.45 111.787 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -48.29 73.27 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.273 -1.01 . . . . 71.23 108.273 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 43.3 m -68.41 -41.73 80.0 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.947 -1.024 . . . . 74.54 111.066 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 62.4 m -61.27 -40.53 94.44 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.307 0.643 . . . . 53.34 110.704 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.556 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -64.4 -44.69 90.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.98 0.512 . . . . 74.23 110.454 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.9 mmt -64.0 -25.86 68.32 Favored 'General case' 0 CA--C 1.558 1.278 0 O-C-N 123.92 0.763 . . . . 73.12 111.844 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -77.14 -44.75 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.843 0.857 . . . . 71.23 110.772 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.5 mtp85 -61.12 -40.6 94.37 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.042 0.937 . . . . 75.12 109.393 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -67.92 -51.61 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 114.099 -1.409 . . . . 75.3 110.002 -177.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 14.5 tmtt? -54.97 -47.95 73.88 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.933 1.293 . . . . 75.04 110.999 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -65.25 -40.7 94.35 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.687 0.617 . . . . 60.14 111.407 -178.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.54 -41.57 98.44 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.21 0.604 . . . . 51.14 111.248 177.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 14' ' ' ILE . 11.0 mp -65.11 -32.17 73.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.335 0.654 . . . . 73.54 111.675 174.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 50.2 mt-10 -64.74 -40.91 96.12 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.685 0.394 . . . . 64.31 110.974 174.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' HB2' HG13 ' A' ' 101' ' ' VAL . 47.8 mt-10 -62.54 -49.69 74.29 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.629 0.581 . . . . 74.31 110.031 177.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.457 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.22 -44.02 92.3 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 123.96 0.787 . . . . 63.03 111.103 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -59.92 -44.69 94.16 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.152 1.381 . . . . 74.14 110.77 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.67 -39.43 93.73 Favored Glycine 0 C--N 1.343 0.952 0 CA-C-N 114.996 -1.002 . . . . 55.5 112.32 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -59.97 -57.89 10.9 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.154 0.477 . . . . 54.45 110.302 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.457 HG12 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -63.55 -23.19 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 112.659 0.614 . . . . 75.24 112.659 177.453 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.406 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 33.4 tt0 -65.16 -44.64 87.9 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.584 0.354 . . . . 73.32 110.921 173.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -87.82 -19.11 27.91 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.513 0.325 . . . . 64.24 111.288 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 11.5 m-30 -82.0 0.84 38.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.43 0.692 . . . . 75.11 111.578 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 74.1 p -57.47 -24.9 58.46 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.316 0.646 . . . . 72.15 110.668 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -85.35 95.59 9.28 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 108.224 -1.028 . . . . 71.54 108.224 168.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.543 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -73.13 -31.63 64.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.715 0.806 . . . . 53.54 112.064 -169.434 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.8 p -74.11 -32.89 63.39 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.978 0.511 . . . . 72.33 110.803 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -66.43 -32.91 74.58 Favored 'General case' 0 C--O 1.249 1.06 0 C-N-CA 123.756 0.822 . . . . 70.42 109.964 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 36.9 mt -55.88 -53.05 42.38 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 109.017 -0.734 . . . . 73.51 109.017 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 148' ' ' PHE . 42.8 t -57.05 -39.35 74.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.909 0.884 . . . . 62.14 111.747 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -58.68 -51.24 70.78 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 114.994 -1.003 . . . . 64.11 110.891 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.41 -23.14 50.67 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.677 0.391 . . . . 63.34 110.831 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -72.21 -47.18 52.47 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.974 0.91 . . . . 74.43 110.506 -172.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -63.12 -29.04 70.48 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.838 -0.619 . . . . 63.33 110.415 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.41 61.03 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.59 0.756 . . . . 71.02 111.029 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 t -71.28 138.3 49.25 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.757 0.823 . . . . 73.31 109.899 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -90.12 -10.22 45.43 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.002 0.921 . . . . 54.11 110.821 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -106.1 149.15 27.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.501 0.667 . . . . 71.41 111.348 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.617 ' HD2' ' HA ' ' A' ' 142' ' ' ASP . 51.0 mtmt -86.84 -27.45 23.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.897 1.279 . . . . 74.42 110.536 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.487 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.5 mp -82.61 116.35 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 107.45 -1.315 . . . . 72.41 107.45 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.433 ' CB ' ' HG2' ' A' ' 27' ' ' GLN . 13.5 tp -69.57 -32.85 71.86 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.44 0.638 . . . . 63.22 111.157 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -109.21 16.76 22.22 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 115.033 -0.985 . . . . 74.2 111.669 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 85.6 tttt -42.54 -57.35 2.7 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.96 1.467 . . . . 74.33 114.96 -163.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.67 -48.7 65.89 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.906 0.882 . . . . 74.33 111.255 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.2 t -61.72 -52.72 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.948 0.899 . . . . 73.44 110.978 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -68.35 -26.32 65.53 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.873 1.269 . . . . 72.35 110.712 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.438 ' NH1' ' HB2' ' A' ' 107' ' ' ASP . 15.3 tpt180 -61.35 -43.59 98.61 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.446 0.699 . . . . 71.05 109.845 168.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -60.26 -49.77 76.29 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 119.046 -0.502 . . . . 61.11 111.577 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.497 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.8 mp -55.33 -37.84 67.96 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-N 118.607 0.639 . . . . 62.22 111.261 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.616 ' HB2' HH12 ' A' ' 34' ' ' ARG . 32.9 t -67.13 -53.03 34.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.804 0.842 . . . . 63.22 111.12 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.576 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 5.7 t70 -78.43 -29.23 46.95 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.745 -0.661 . . . . 74.21 111.146 -170.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 70.3 t -79.46 -27.38 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.947 0.499 . . . . 73.51 110.165 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.559 ' HH2' HG12 ' A' ' 124' ' ' VAL . 20.2 t-105 -65.45 -39.73 92.37 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 118.717 0.69 . . . . 73.51 110.21 168.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.576 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 49.2 mtpt -54.92 -59.05 5.27 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 123.494 0.496 . . . . 73.41 109.793 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 50.0 mt-10 -53.45 -47.96 69.26 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.523 1.14 . . . . 51.13 110.568 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 2.6 tp -57.91 -59.66 4.9 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.382 1.073 . . . . 63.24 109.592 -173.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.3 t -55.08 -41.41 71.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.675 1.19 . . . . 64.05 112.103 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.41 -47.21 67.87 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.074 -0.512 . . . . 73.43 111.996 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.556 HD21 ' HB2' ' A' ' 61' ' ' ALA . 4.2 pp -78.4 -19.29 53.6 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.818 -0.551 . . . . 72.02 111.43 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.449 ' HG ' ' HE2' ' A' ' 122' ' ' MET . 2.0 mp -63.46 -53.36 53.31 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.923 -0.769 . . . . 65.11 108.923 169.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -72.18 -27.69 62.72 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.651 0.38 . . . . 73.05 112.024 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.93 -63.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.852 0.461 . . . . 62.31 110.956 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -85.36 -58.23 2.76 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.486 0.715 . . . . 74.53 111.484 -165.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -88.55 -2.97 58.89 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.284 0.634 . . . . 75.25 110.318 -176.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 54.85 35.85 25.21 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.73 1.612 . . . . 35.12 112.363 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.483 ' HB3' HG23 ' A' ' 124' ' ' VAL . 27.7 mtm -95.66 129.3 34.97 Favored Pre-proline 0 N--CA 1.477 0.917 0 O-C-N 121.669 -0.644 . . . . 63.12 110.336 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -89.41 30.87 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.523 2.815 . . . . 53.13 112.11 -175.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.559 HG12 ' HH2' ' A' ' 109' ' ' TRP . 46.6 t -72.4 91.45 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 123.91 0.884 . . . . 62.31 110.437 -172.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.0 t -163.22 70.41 1.9 Allowed Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.02 0.928 . . . . 75.44 109.018 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.88 -3.28 7.24 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.889 2.393 . . . . 75.01 112.365 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.0 tt -121.55 19.4 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.954 1.302 . . . . 63.14 109.44 -171.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.2 t 69.71 -177.63 0.21 Allowed 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 114.272 -1.331 . . . . 64.33 110.873 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -81.87 9.36 8.24 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.847 0.859 . . . . 71.2 110.685 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 94.96 29.74 8.87 Favored Glycine 0 C--N 1.342 0.873 0 N-CA-C 112.619 -0.192 . . . . 72.22 112.619 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -71.09 -42.39 69.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.893 0.477 . . . . 44.32 110.445 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 23.8 m -65.82 -30.31 70.92 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.602 -0.726 . . . . 74.41 111.13 172.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 22.0 m0 -68.93 -23.99 64.23 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.753 1.02 . . . . 73.31 113.753 -170.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.77 -25.26 48.94 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 120.796 0.331 . . . . 71.55 111.557 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -89.71 -50.83 5.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.738 0.815 . . . . 62.45 111.126 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 133' ' ' TRP . 11.5 pt-20 -57.05 -42.33 80.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.528 0.731 . . . . 42.44 111.754 -174.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.0 OUTLIER -60.09 -51.26 70.36 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.152 0.581 . . . . 63.32 112.012 -177.355 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -69.42 -39.27 77.97 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.219 0.324 . . . . 54.34 111.515 -175.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -66.99 -57.91 5.97 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.642 0.734 . . . . 50.51 111.3 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.614 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 1.2 m-20 -55.53 -51.92 65.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.194 -1.366 . . . . 73.4 111.119 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -66.93 -27.26 67.34 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.286 0.476 . . . . 73.31 112.286 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.617 ' HA ' ' HD2' ' A' ' 95' ' ' LYS . 18.8 t70 -58.83 -58.45 8.58 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.102 -0.703 . . . . 74.03 109.102 172.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.58 -25.15 65.63 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.802 -1.544 . . . . 62.32 111.609 -177.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.431 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.2 t0 -84.51 -42.26 15.71 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.634 0.774 . . . . 75.43 111.898 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.418 ' HG2' ' HG2' ' A' ' 95' ' ' LYS . 9.9 tpt180 -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.751 0.82 . . . . 74.01 109.13 170.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -61.79 -43.96 97.82 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.409 -1.269 . . . . 73.5 110.773 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.1 -18.08 60.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.331 0.653 . . . . 71.04 112.325 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.548 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.5 OUTLIER -78.42 -60.81 2.22 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.967 -0.753 . . . . 73.22 108.967 176.267 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -73.73 -51.27 17.08 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.803 -1.09 . . . . 70.43 110.866 -171.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 28.4 mmt -101.82 51.74 0.83 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.065 -0.716 . . . . 73.13 109.065 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.8 tt -70.61 107.6 3.98 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.152 -0.931 . . . . 73.32 109.443 -176.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -128.08 96.73 4.55 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 107.395 -1.335 . . . . 73.12 107.395 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -153.37 -70.1 0.14 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.49 -0.323 . . . . 75.5 110.877 -173.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -127.25 -59.76 1.22 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.744 -1.206 . . . . 64.12 107.744 178.023 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 16.9 m120 58.89 27.53 16.32 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.316 1.046 . . . . 62.2 112.044 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 CA--C 1.564 1.485 0 C-N-CA 124.497 1.119 . . . . 75.35 110.891 -179.925 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 119.751 -0.166 . . . . 72.11 111.332 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.15 -43.2 95.92 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.318 0.647 . . . . 62.32 111.247 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -67.76 -38.25 83.2 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.863 -0.608 . . . . 73.22 109.694 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' A' ' 42' ' ' LEU . 31.6 tp -69.23 -36.52 77.28 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.134 -0.939 . . . . 62.41 110.734 176.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 46' ' ' GLN . 3.2 tmtp? -63.6 -42.44 98.23 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 108.612 -0.885 . . . . 73.42 108.612 177.594 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -58.41 -44.74 89.14 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.291 0.994 . . . . 70.31 110.765 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.401 HD11 ' HA ' ' A' ' 62' ' ' MET . 82.1 mt -54.31 -50.94 52.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 124.191 0.996 . . . . 51.1 111.077 174.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 4' ' ' LEU . 24.9 mm -63.27 -43.71 98.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.989 0.916 . . . . 71.35 111.02 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.8 m -64.15 -48.55 75.57 Favored 'General case' 0 C--N 1.348 0.511 0 O-C-N 123.966 0.791 . . . . 74.41 110.325 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.0 -45.87 86.15 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 124.025 0.828 . . . . 73.43 110.72 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.568 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -59.97 -46.05 94.82 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 124.346 1.029 . . . . 24.3 113.027 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -63.38 -49.63 73.07 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 122.56 0.344 . . . . 64.33 110.627 178.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 84.3 t -60.84 -33.15 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.759 0.824 . . . . 73.51 110.932 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.462 HG21 HG21 ' A' ' 35' ' ' VAL . 17.3 mt -57.82 -54.68 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.179 0.992 . . . . 72.54 109.007 174.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -62.2 -31.28 71.79 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.013 0.82 . . . . 72.01 111.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.86 -59.95 3.08 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.719 0.407 . . . . 72.11 111.172 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 16.4 ptp180 -73.34 -16.56 61.36 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 112.621 0.6 . . . . 70.34 112.621 -175.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.41 ' SG ' HD23 ' A' ' 31' ' ' LEU . 46.1 t -66.72 -22.83 66.05 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.305 0.642 . . . . 43.43 110.864 173.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -76.34 2.91 12.14 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 60.31 111.836 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -86.54 -1.22 57.45 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.536 0.734 . . . . 75.04 111.978 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 15.0 mmt -80.81 95.9 6.82 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.912 0.387 . . . . 74.44 110.987 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HB3' ' HG2' ' A' ' 82' ' ' ARG . 12.1 tptt -67.97 -41.1 82.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.546 1.138 . . . . 51.3 110.014 170.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -97.17 -178.66 4.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 114.979 -1.01 . . . . 72.4 109.225 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.9 p 46.68 62.35 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.768 1.227 . . . . 71.13 111.608 175.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 22' ' ' LYS . 32.8 mmtp -73.39 -38.95 65.46 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.58 -1.191 . . . . 65.21 111.742 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 140' ' ' ASP . 58.8 tptt -63.26 -47.67 81.42 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.832 -1.174 . . . . 74.11 107.832 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.4 ' HG2' HD12 ' A' ' 97' ' ' LEU . 3.0 tp-100 -46.82 -54.37 10.01 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.848 1.659 . . . . 72.43 111.129 175.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 20.4 t -62.17 -50.78 70.47 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.725 1.21 . . . . 63.4 112.88 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -73.6 -37.75 65.33 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.207 0.603 . . . . 74.12 111.8 -171.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -81.15 -28.13 35.19 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.304 0.377 . . . . 74.41 110.066 -178.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.41 HD23 ' SG ' ' A' ' 18' ' ' CYS . 69.2 tp -62.26 -51.13 68.98 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 108.262 -1.014 . . . . 65.22 108.262 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.1 -36.2 91.98 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 124.152 0.908 . . . . 60.51 113.089 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -64.49 -53.92 40.61 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 124.031 0.933 . . . . 64.43 110.348 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -46.9 -60.69 2.27 Favored 'General case' 0 C--N 1.367 1.362 0 O-C-N 124.992 1.433 . . . . 54.23 109.282 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.462 HG21 HG21 ' A' ' 14' ' ' ILE . 48.2 t -57.64 -48.1 84.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 125.182 1.393 . . . . 74.53 112.596 -171.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.5 mt -65.48 -50.13 66.46 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 118.442 0.565 . . . . 61.33 110.726 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.12 -19.66 66.25 Favored Glycine 0 C--N 1.351 1.405 0 O-C-N 123.78 0.675 . . . . 60.22 112.752 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.554 HD11 ' HZ ' ' A' ' 65' ' ' PHE . 19.2 tp -84.46 -50.32 7.86 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.571 1.148 . . . . 73.43 111.974 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.568 HG21 ' HA3' ' A' ' 11' ' ' GLY . 10.1 pt -79.21 -30.95 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.1 0.56 . . . . 63.41 111.221 -171.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 15.4 tppt? -58.68 -53.98 60.85 Favored Pre-proline 0 CA--C 1.567 1.608 0 CA-C-O 118.031 -0.985 . . . . 71.41 113.033 -174.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -61.17 -31.09 89.8 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 121.613 1.542 . . . . 75.03 112.303 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 4' ' ' LEU . 4.3 mm? -78.03 -36.55 48.45 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.448 0.699 . . . . 74.03 111.24 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 12.0 pt-20 -77.79 -20.34 53.47 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 119.192 -0.432 . . . . 65.51 111.574 -177.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.0 mmt -60.53 -56.31 22.87 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.45 0.469 . . . . 64.02 110.681 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 pp -72.64 -30.83 64.64 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.1 0.56 . . . . 75.21 111.437 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.525 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.0 OUTLIER -64.03 -44.61 92.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.507 0.723 . . . . 73.24 111.051 175.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.88 -37.2 85.96 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.864 0.866 . . . . 71.24 111.121 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -65.59 -24.66 67.13 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.908 -1.042 . . . . 63.52 110.892 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.69 29.01 60.12 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.536 0.522 . . . . 72.01 113.366 172.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -82.28 119.78 24.54 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.779 -0.452 . . . . 53.34 109.779 -177.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -54.9 -41.88 71.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.924 0.89 . . . . 75.3 110.932 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.5 m 63.77 -160.44 0.3 Allowed 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.585 1.178 . . . . 73.15 109.809 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.52 87.24 5.07 Favored Pre-proline 0 CA--C 1.55 0.966 0 N-CA-C 108.208 -1.034 . . . . 75.4 108.208 165.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.576 ' HA ' ' HG ' ' A' ' 58' ' ' LEU . 97.4 Cg_endo -93.26 95.45 0.15 Allowed 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.907 2.404 . . . . 52.13 111.65 176.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.1 m -67.42 -177.52 0.73 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.859 0.864 . . . . 71.3 111.79 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -62.67 -37.91 88.26 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.822 0.449 . . . . 72.24 111.011 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -67.49 -31.6 71.85 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.334 0.654 . . . . 72.54 111.031 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' ' 54' ' ' PRO . 4.2 mm? -66.09 -50.74 63.02 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.105 0.562 . . . . 75.42 109.522 174.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 m -58.39 -48.68 79.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.174 0.99 . . . . 72.11 111.228 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -61.76 -43.97 97.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.057 0.943 . . . . 75.45 110.671 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.54 98.82 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.857 0.723 . . . . 73.25 110.928 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.406 ' SD ' ' HB2' ' A' ' 4' ' ' LEU . 31.2 mmt -64.38 -43.03 95.75 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.507 0.723 . . . . 62.41 110.694 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -66.6 -39.57 88.46 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 124.004 0.922 . . . . 72.15 111.3 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.423 ' HE ' HG22 ' A' ' 108' ' ' VAL . 49.7 ttt85 -72.34 -38.07 68.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.583 1.553 . . . . 75.31 111.002 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.554 ' HZ ' HD11 ' A' ' 38' ' ' LEU . 2.4 t80 -73.87 -43.77 57.52 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.896 -1.047 . . . . 63.41 109.515 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.0 ttpp -55.97 -47.42 77.69 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 114.288 -1.323 . . . . 61.35 109.925 172.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.87 92.2 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.826 0.85 . . . . 74.41 111.643 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.584 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.02 -42.3 98.2 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 115.421 -0.809 . . . . 74.43 110.978 175.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.02 -26.7 62.32 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.378 0.671 . . . . 72.43 111.852 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 97.8 mt-10 -65.58 -43.81 88.6 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 108.664 -0.865 . . . . 75.44 108.664 175.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 50.8 mt-10 -61.03 -52.69 63.92 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.741 -1.118 . . . . 70.34 110.365 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.91 -45.99 82.26 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 124.085 0.866 . . . . 71.55 111.454 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.08 -36.04 80.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.513 1.125 . . . . 71.5 110.28 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 77' ' ' GLU . . . -69.38 -36.02 77.22 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.289 -0.869 . . . . 72.02 112.881 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 14.4 mm-40 -65.33 -55.41 18.38 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.528 0.664 . . . . 73.03 110.041 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.521 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.2 pt -64.2 -27.06 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 112.581 0.586 . . . . 65.54 112.581 176.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.443 ' HB3' ' O ' ' A' ' 74' ' ' GLY . 11.3 tt0 -56.39 -49.13 75.36 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.957 0.503 . . . . 72.54 110.669 169.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -78.03 -28.89 49.15 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.188 0.595 . . . . 60.24 110.968 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.443 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 19.2 m-30 -81.05 -5.8 58.05 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.767 0.827 . . . . 72.24 112.323 -178.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 97.1 p -60.14 -33.06 71.64 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.413 -0.588 . . . . 63.13 109.413 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -82.66 109.13 16.57 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.678 -1.23 . . . . 63.34 107.678 165.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.647 ' HG2' ' HB3' ' A' ' 22' ' ' LYS . 3.4 mpt_? -74.53 -25.65 59.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.25 0.62 . . . . 61.35 111.645 -172.121 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.3 m -62.84 -37.3 86.25 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.839 0.856 . . . . 53.32 110.592 174.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -60.35 -39.22 86.37 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 124.371 1.068 . . . . 75.2 111.072 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 26.0 mt -59.64 -53.96 41.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.201 0 O-C-N 123.829 0.706 . . . . 65.3 109.653 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 16.9 t -62.07 -38.05 87.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.13 0.572 . . . . 72.21 111.717 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.3 tpp180 -59.86 -47.88 83.97 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.389 1.076 . . . . 75.52 110.96 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.81 -22.39 40.07 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 116.15 -0.477 . . . . 75.01 110.555 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 17.3 tp -71.81 -41.24 68.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.776 0.831 . . . . 62.12 110.717 -173.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -71.22 -21.37 62.14 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.896 -0.593 . . . . 74.02 110.565 176.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.75 10.94 32.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.156 0.983 . . . . 55.52 111.058 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.4 t -70.92 124.38 24.2 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 123.14 0.576 . . . . 74.11 110.718 -174.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -83.34 -7.02 59.64 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.757 -1.111 . . . . 64.14 110.381 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -127.84 -172.51 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.151 0.981 . . . . 55.43 110.683 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.479 ' HG3' ' HB1' ' A' ' 141' ' ' ALA . 18.6 tptm -108.07 -39.67 5.44 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.772 0.829 . . . . 73.12 109.749 -176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.803 HG13 ' HB2' ' A' ' 141' ' ' ALA . 1.4 mp -87.64 153.17 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.15 -1.055 . . . . 65.31 108.15 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.4 HD12 ' HG2' ' A' ' 27' ' ' GLN . 26.3 mt -76.93 -46.84 22.82 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.909 0.862 . . . . 74.01 108.792 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.521 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 13.8 m-85 -98.51 34.6 1.98 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.152 -1.386 . . . . 73.52 110.455 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.663 ' HG3' HD13 ' A' ' 96' ' ' ILE . 22.1 ttpt -52.58 -65.2 0.6 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.735 0.698 . . . . 74.55 112.058 -172.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -65.92 -47.85 73.39 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.82 0.7 . . . . 74.54 110.558 -173.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 84.4 t -60.7 -57.82 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 124.287 0.992 . . . . 72.0 111.951 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -72.32 -24.16 61.27 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.811 0.844 . . . . 75.15 111.273 -174.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -66.94 -35.9 81.03 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.95 -0.389 . . . . 74.14 109.95 168.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 108' ' ' VAL . 60.1 mtpt -69.67 -37.81 76.83 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 119.113 -0.47 . . . . 63.12 110.64 172.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.584 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.9 mp -55.61 -45.2 77.54 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.553 -0.536 . . . . 74.2 109.553 171.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -63.11 -53.86 46.9 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 124.127 0.892 . . . . 42.14 110.885 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -60.7 -52.92 63.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.549 1.14 . . . . 70.43 111.508 -174.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.423 HG22 ' HE ' ' A' ' 64' ' ' ARG . 59.1 t -63.02 -42.97 98.69 Favored 'Isoleucine or valine' 0 C--N 1.344 0.346 0 O-C-N 124.07 0.856 . . . . 73.12 110.345 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.404 ' HE1' HD13 ' A' ' 127' ' ' ILE . 25.8 t-105 -61.76 -35.24 77.55 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.374 0.422 . . . . 73.33 111.403 177.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 57.6 mtpt -61.24 -55.35 32.99 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.712 -0.477 . . . . 74.14 109.712 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.1 -41.48 75.31 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.007 0.923 . . . . 73.53 111.05 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 3.7 tt -75.0 -47.78 27.42 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 114.115 -1.402 . . . . 72.04 110.45 -170.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.3 p -65.22 -33.41 75.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.222 0.609 . . . . 63.43 110.541 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.44 ' O ' HG23 ' A' ' 118' ' ' VAL . 80.0 mt -60.21 -57.13 14.12 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.892 0.745 . . . . 71.21 110.453 172.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.12 -23.77 67.23 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 111.801 0.297 . . . . 71.4 111.801 -178.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.7 mt -70.28 -45.58 66.06 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.876 -0.416 . . . . 72.34 109.876 171.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.424 ' O ' ' HA ' ' A' ' 121' ' ' ARG . 30.0 tt0 -77.13 -19.71 56.54 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.611 0.764 . . . . 61.11 111.185 -174.312 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 114' ' ' LEU . 64.1 t -91.36 -56.42 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 122.947 0.499 . . . . 74.34 110.288 177.17 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -73.51 -59.13 2.86 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.082 0.468 . . . . 71.44 110.736 -175.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -84.93 -16.43 41.1 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.588 -0.733 . . . . 72.33 110.767 -175.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 60.4 mtm-85 57.14 44.16 22.86 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.443 1.097 . . . . 54.24 110.013 -175.343 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.464 ' SD ' HD13 ' A' ' 116' ' ' LEU . 44.7 ttm -70.86 127.42 91.79 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 114.637 -1.165 . . . . 70.23 111.081 -174.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 6.3 Cg_exo -77.24 93.89 1.07 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.729 2.286 . . . . 64.33 109.846 170.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.84 113.25 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-O 121.327 0.584 . . . . 61.24 110.636 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.4 t -164.83 73.7 1.5 Allowed Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.141 0.976 . . . . 24.1 108.982 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -87.08 -3.21 7.98 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.838 2.358 . . . . 74.53 111.992 172.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.404 HD13 ' HE1' ' A' ' 109' ' ' TRP . 30.0 pt -97.16 153.37 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 C-N-CA 123.893 0.877 . . . . 60.34 109.239 -176.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 25.1 m -74.49 78.09 1.94 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.409 0.683 . . . . 54.44 110.233 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 72.0 -62.78 0.45 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.217 1.407 . . . . 72.54 112.963 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.03 -19.01 7.85 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 110.982 -0.847 . . . . 54.03 110.982 -167.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -74.75 -46.73 35.32 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.727 0.811 . . . . 75.15 110.585 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 59.5 p -71.96 -14.12 61.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.26 -0.882 . . . . 74.33 111.412 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -20.45 64.89 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.822 0.849 . . . . 74.32 112.292 175.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -84.0 -34.08 24.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.0 0.52 . . . . 61.5 111.492 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -80.0 -33.05 39.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.897 0.879 . . . . 72.41 111.584 -173.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -59.88 -37.54 79.65 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 123.492 0.495 . . . . 63.51 109.825 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.87 -37.71 83.06 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.628 1.171 . . . . 75.35 111.573 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -68.84 -50.31 51.1 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.265 0.353 . . . . 73.03 111.287 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.1 -42.02 93.78 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 123.806 0.691 . . . . 74.02 110.481 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.468 ' HA ' ' HG2' ' A' ' 26' ' ' LYS . 1.4 t70 -60.7 -54.1 49.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.052 1.741 . . . . 63.02 110.918 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.803 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -53.98 -53.02 58.61 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.13 -1.396 . . . . 51.04 112.067 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.57 -45.33 85.32 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.1 -1.409 . . . . 73.32 111.114 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.418 ' HG2' HH12 ' A' ' 153' ' ' ARG . 25.0 tt0 -64.22 -52.47 58.63 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 124.728 1.268 . . . . 53.21 111.159 -172.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.51 -38.01 68.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 124.022 0.826 . . . . 63.45 111.725 -174.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 149' ' ' GLN . 0.0 OUTLIER -57.41 -50.23 73.68 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.498 0.499 . . . . 62.11 109.891 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.415 ' N ' ' HD3' ' A' ' 145' ' ' ARG . 5.7 tmm_? -71.47 -31.19 66.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.501 0.72 . . . . 63.45 110.035 -176.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.2 -19.83 53.09 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.189 0.596 . . . . 52.43 111.675 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -80.42 -50.94 9.43 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.772 -0.825 . . . . 75.15 108.772 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 149' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 145' ' ' ARG . 25.1 mm-40 -60.82 -60.19 4.19 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.902 0.752 . . . . 63.21 109.581 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 5.9 mmt -99.8 66.67 1.41 Allowed 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.361 1.064 . . . . 52.33 109.071 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp -75.52 85.88 2.61 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-O 121.986 0.898 . . . . 53.54 109.864 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -109.7 -9.83 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.026 -0.988 . . . . 71.1 109.646 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.418 HH12 ' HG2' ' A' ' 143' ' ' GLU . 97.0 mtt180 -63.75 -28.48 69.91 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.23 1.012 . . . . 71.4 110.593 170.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -117.57 -66.49 1.07 Allowed 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.727 0.811 . . . . 74.21 109.951 170.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 7.0 t30 58.13 89.28 0.05 Allowed 'General case' 0 N--CA 1.48 1.053 0 O-C-N 124.332 1.02 . . . . 74.05 110.311 -173.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 . . . . . 0 CA--C 1.555 1.17 0 C-N-CA 123.676 0.791 . . . . 64.24 109.507 -173.61 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttp . . . . . 0 N--CA 1.483 1.201 0 N-CA-C 109.971 -0.381 . . . . 75.13 109.971 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -58.23 -50.48 73.43 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.139 0.976 . . . . 64.31 110.964 -177.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -68.88 -36.75 78.47 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 116.023 -0.535 . . . . 71.35 111.265 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.453 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.1 mm? -62.97 -47.26 83.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.544 0.337 . . . . 62.41 110.519 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 51.8 tptt -57.42 -43.27 83.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.309 0.644 . . . . 72.41 109.829 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -61.57 -63.98 1.09 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-O 118.385 -0.816 . . . . 72.32 111.085 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.0 mt -47.98 -45.59 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.094 0.958 . . . . 71.31 112.917 -174.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -70.92 -48.55 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 115.647 -0.706 . . . . 44.15 110.987 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.1 m -61.62 -48.55 80.37 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 123.179 0.299 . . . . 74.1 110.305 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -57.19 -45.02 84.11 Favored 'General case' 0 C--O 1.208 -1.118 0 C-N-CA 124.648 1.179 . . . . 55.32 110.949 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.431 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -63.15 -42.29 99.49 Favored Glycine 0 C--N 1.347 1.167 0 O-C-N 124.244 0.965 . . . . 72.43 113.075 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -65.13 -43.24 92.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.198 0.599 . . . . 62.13 111.753 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -76.03 -25.29 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.619 0.767 . . . . 62.03 110.541 -178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.46 -51.77 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.841 0.856 . . . . 74.11 108.877 171.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -61.32 -36.54 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 124.12 0.888 . . . . 74.3 110.335 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -56.02 19.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.428 1.091 . . . . 74.21 110.56 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.491 ' HD2' HG13 ' A' ' 76' ' ' ILE . 5.2 ptp180 -75.84 -16.28 60.1 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.679 -0.691 . . . . 72.13 111.723 -178.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 48.2 t -72.15 -21.53 61.44 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.29 0.636 . . . . 70.24 110.54 172.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -81.18 0.01 38.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.502 0.721 . . . . 74.45 111.979 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.5 -29.73 70.41 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.457 -0.572 . . . . 55.41 109.457 165.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.1 mmt -71.15 89.57 0.85 Allowed 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.066 -0.516 . . . . 72.12 109.623 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -75.25 -27.21 59.37 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 108.496 -0.927 . . . . 72.32 108.496 170.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -93.33 172.32 8.36 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.597 1.159 . . . . 60.31 108.319 163.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.461 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 28.5 m 51.93 48.69 22.27 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.275 0.56 . . . . 53.25 110.878 -176.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 94.5 mttt -63.78 -41.04 98.02 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.047 -0.978 . . . . 72.13 111.035 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 0.5 OUTLIER -75.97 -22.92 55.4 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.958 -0.565 . . . . 54.33 109.735 -176.84 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.608 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 11.7 mm-40 -69.47 -40.56 77.02 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 123.005 0.522 . . . . 75.13 110.665 168.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.572 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 41.9 t -59.25 -42.63 91.55 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.359 0.663 . . . . 73.21 110.001 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 11.5 mpt_? -77.12 -30.31 55.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.429 -0.805 . . . . 74.44 111.859 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 ttp85 -71.39 -60.03 2.45 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.369 0.668 . . . . 63.02 110.453 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 18' ' ' CYS . 46.9 tp -56.61 -43.8 80.51 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.714 -1.13 . . . . 73.22 109.978 174.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.09 -49.12 74.27 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.103 0.877 . . . . 72.51 113.192 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -60.95 -47.76 84.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.811 0.845 . . . . 73.43 110.903 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 31.5 mtt180 -60.59 -60.33 3.98 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.093 0.871 . . . . 72.21 111.286 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.91 -45.07 75.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 124.306 1.004 . . . . 63.44 111.528 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.49 -44.16 97.57 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.623 0.577 . . . . 74.51 110.752 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.09 -25.82 71.14 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 123.517 0.511 . . . . 62.13 113.521 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 40.8 mt -79.96 -49.8 11.34 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.385 0.674 . . . . 74.13 110.983 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 10.5 pt -74.43 -33.69 33.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 CA-C-O 118.372 -0.823 . . . . 73.44 111.224 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -44.53 -58.61 4.95 Favored Pre-proline 0 N--CA 1.503 2.2 0 C-N-CA 124.914 1.286 . . . . 65.44 113.87 -170.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.46 ' HG2' HD22 ' A' ' 42' ' ' LEU . 35.0 Cg_endo -62.72 -42.05 27.69 Favored 'Trans proline' 0 C--N 1.401 3.338 0 C-N-CA 121.383 1.389 . . . . 75.34 110.692 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.6 mm? -70.11 -20.2 63.2 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.571 0.748 . . . . 63.4 111.499 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' HG23 ' A' ' 8' ' ' ILE . 63.7 mt-10 -73.62 -45.31 53.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.796 0.839 . . . . 73.02 109.561 175.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.4 -33.18 74.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.659 -0.7 . . . . 70.12 110.802 174.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.09 -21.06 36.97 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.007 0.923 . . . . 32.33 111.847 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -75.27 -38.11 60.6 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.765 0.426 . . . . 55.15 110.042 173.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -64.4 -30.86 71.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.391 0.677 . . . . 71.04 110.407 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -98.91 2.18 46.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.005 0.922 . . . . 73.33 111.576 174.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -69.64 135.4 26.82 Favored Glycine 0 C--N 1.343 0.963 0 O-C-N 123.483 0.489 . . . . 71.22 112.614 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.02 -173.12 4.39 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.564 0.745 . . . . 63.11 109.068 -176.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -63.62 90.14 0.05 Allowed 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.522 0.729 . . . . 75.23 109.521 174.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.0 m -104.08 170.38 7.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.381 -1.281 . . . . 73.23 108.575 176.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.9 t -113.4 90.76 17.97 Favored Pre-proline 0 CA--C 1.551 0.985 0 N-CA-C 108.615 -0.883 . . . . 62.12 108.615 177.162 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -84.81 150.31 11.18 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.666 2.244 . . . . 73.3 112.327 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m -73.52 163.39 28.1 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.917 0.487 . . . . 73.54 110.389 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.47 -32.14 73.32 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 110.168 -0.308 . . . . 72.11 110.168 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -71.77 -30.87 66.03 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.487 0.315 . . . . 74.31 111.132 175.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.1 -51.21 57.08 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 107.883 -1.155 . . . . 73.44 107.883 176.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.1 m -58.06 -47.59 82.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.454 1.102 . . . . 75.14 111.198 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.4 m -65.88 -40.9 92.04 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.768 0.827 . . . . 70.33 111.14 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.48 -41.68 96.34 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.803 0.441 . . . . 70.01 110.283 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.51 -26.67 64.65 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.105 0.562 . . . . 55.22 111.261 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.51 ' HA ' ' HE2' ' A' ' 66' ' ' LYS . 84.8 m-20 -76.44 -38.28 55.73 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.466 0.706 . . . . 73.34 110.632 176.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.19 -39.51 78.64 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.737 0.815 . . . . 74.11 109.811 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -67.62 -49.0 65.17 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.286 1.034 . . . . 72.24 109.014 -177.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 63' ' ' ASN . 37.1 ttpt -55.59 -46.1 77.3 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.054 1.342 . . . . 74.13 111.754 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -70.56 -32.22 69.55 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.463 0.705 . . . . 75.11 111.454 -177.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -71.02 -32.43 69.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.356 0.662 . . . . 72.12 109.885 175.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 95.1 mt -73.11 -27.59 61.78 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.595 -0.73 . . . . 60.14 110.502 173.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -66.55 -41.78 88.16 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.777 0.431 . . . . 74.03 110.637 171.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.43 ' HB2' HG13 ' A' ' 101' ' ' VAL . 16.5 mm-40 -60.58 -49.29 78.13 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.63 0.581 . . . . 64.13 109.977 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.506 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.18 -46.8 88.47 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.9 0.75 . . . . 73.42 111.264 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.19 -47.53 78.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.5 1.12 . . . . 74.23 110.599 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.73 -37.73 94.72 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.083 -0.962 . . . . 63.2 112.878 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -61.46 -53.07 61.3 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.0 0.52 . . . . 71.42 110.978 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.568 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -69.12 -20.31 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 N-CA-C 112.239 0.459 . . . . 72.04 112.239 179.305 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -67.26 -41.03 86.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.262 0.553 . . . . 64.01 111.055 168.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -71.97 -30.23 65.06 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.127 -0.942 . . . . 73.42 110.816 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.4 m-85 -83.97 -8.17 59.22 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.741 0.817 . . . . 72.31 112.271 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 9.1 t -61.9 -22.11 65.3 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.241 0.543 . . . . 73.45 110.291 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -86.05 108.55 18.31 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.212 -1.033 . . . . 64.43 108.212 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -75.54 -23.84 56.67 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.864 0.465 . . . . 74.35 110.595 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.1 m -67.9 -35.0 77.72 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.131 0.572 . . . . 74.42 110.58 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -64.07 -38.3 90.58 Favored 'General case' 0 C--O 1.25 1.11 0 C-N-CA 123.209 0.604 . . . . 73.33 110.096 175.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.497 HG23 HD11 ' A' ' 97' ' ' LEU . 32.8 mt -59.81 -56.73 15.42 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 123.816 0.698 . . . . 72.32 109.177 174.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -56.54 -38.22 71.56 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.361 0.664 . . . . 71.23 111.762 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 ttm180 -56.05 -59.18 5.28 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 124.664 1.228 . . . . 75.51 111.028 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.75 -25.6 56.67 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 116.058 -0.519 . . . . 75.42 110.206 -175.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.6 tp -74.13 -41.33 61.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.547 0.739 . . . . 74.51 110.03 -169.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -66.17 -22.76 66.37 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 123.434 0.459 . . . . 73.4 110.598 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 -28.91 19.2 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.056 0.943 . . . . 64.04 111.546 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.4 p -81.16 102.78 10.52 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.917 0.487 . . . . 71.04 111.34 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -74.52 -1.37 21.04 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.491 0.716 . . . . 71.14 110.885 171.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.27 -39.97 93.29 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.175 0.99 . . . . 64.52 110.912 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 142' ' ' ASP . 0.0 OUTLIER 74.36 -53.05 0.68 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 126.289 1.835 . . . . 73.44 111.548 -170.071 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.462 ' H ' HD12 ' A' ' 96' ' ' ILE . 3.0 mp -67.56 116.29 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.664 -0.865 . . . . 55.34 108.664 -177.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.608 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 9.3 tp -56.48 -30.37 62.87 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 124.329 1.018 . . . . 62.11 112.074 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 28.1 m-85 -121.57 26.94 8.5 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 114.616 -1.174 . . . . 72.32 111.716 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -40.03 -63.71 0.58 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.398 1.079 . . . . 71.5 112.183 -169.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.48 -61.55 2.51 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.581 1.152 . . . . 72.13 111.86 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.43 HG13 ' HB2' ' A' ' 71' ' ' GLU . 96.9 t -59.79 -56.32 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.681 1.192 . . . . 72.21 111.685 -172.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.483 ' HB2' ' HB3' ' A' ' 98' ' ' PHE . 50.7 t30 -61.07 -33.63 73.64 Favored 'General case' 0 C--O 1.245 0.864 0 C-N-CA 124.926 1.29 . . . . 74.33 112.517 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -41.36 97.31 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 109.47 -0.567 . . . . 65.53 109.47 172.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -68.85 -31.9 71.19 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.786 -0.643 . . . . 73.44 112.442 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.81 -49.36 78.0 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.533 -0.543 . . . . 73.51 109.533 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.7 t -66.51 -32.77 74.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.806 0.842 . . . . 72.45 111.52 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 15.0 t70 -70.19 -51.39 31.47 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.656 0.783 . . . . 74.32 110.433 -178.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.5 -27.67 37.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-N 116.042 -0.526 . . . . 73.1 110.337 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 48.5 t-105 -69.42 -37.15 77.3 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 122.804 0.442 . . . . 75.34 111.462 174.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 32.5 pttt -66.49 -40.04 89.07 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 108.217 -1.031 . . . . 74.21 108.217 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 42.0 mt-10 -60.56 -47.96 83.87 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 123.526 0.516 . . . . 74.34 110.41 174.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.403 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -56.51 -61.36 2.46 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 124.842 1.339 . . . . 63.21 108.718 -177.599 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.4 t -49.26 -43.41 42.92 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.03 1.332 . . . . 52.45 111.274 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.419 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.4 mt -58.3 -66.15 0.53 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 123.832 0.708 . . . . 74.43 111.896 175.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.9 pp -62.93 -27.68 69.55 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.241 0.46 . . . . 64.43 112.241 -172.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.46 ' HB3' ' HE3' ' A' ' 122' ' ' MET . 95.1 mt -70.69 -48.36 55.11 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.067 0.947 . . . . 73.44 110.673 176.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -78.83 -20.68 49.06 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.508 0.323 . . . . 74.13 111.644 -175.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 114' ' ' LEU . 98.1 t -81.1 -55.38 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 110.014 -0.365 . . . . 60.42 110.014 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -87.56 -58.52 2.55 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 111.729 0.27 . . . . 54.42 111.729 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -76.81 -8.02 56.53 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.417 0.287 . . . . 74.52 111.239 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 58.31 32.88 22.6 Favored 'General case' 0 C--N 1.36 1.027 0 C-N-CA 124.621 1.168 . . . . 72.21 111.243 177.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.46 ' HE3' ' HB3' ' A' ' 116' ' ' LEU . 35.0 ttm -72.24 124.92 91.47 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 114.93 -1.032 . . . . 75.12 110.921 -174.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.46 79.61 3.28 Favored 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.463 2.109 . . . . 74.53 110.984 178.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.409 HG21 ' HG3' ' A' ' 41' ' ' PRO . 12.9 p -145.16 112.8 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.595 -0.729 . . . . 74.34 110.158 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.3 t -169.78 71.2 0.65 Allowed Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.62 1.168 . . . . 54.43 108.448 171.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -88.78 32.06 0.39 Allowed 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 123.019 2.48 . . . . 74.12 110.959 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 9.8 tt -154.3 -38.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.698 0 C-N-CA 124.347 1.059 . . . . 63.21 109.975 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.9 m 65.48 -76.56 0.04 OUTLIER 'General case' 0 C--N 1.359 0.998 0 C-N-CA 125.418 1.487 . . . . 51.12 111.885 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.1 20.55 1.93 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.932 0.493 . . . . 72.14 109.873 -178.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 78.1 36.74 30.71 Favored Glycine 0 C--N 1.343 0.954 0 O-C-N 122.097 -0.377 . . . . 54.24 113.047 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.33 -55.44 24.59 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.387 0.675 . . . . 62.21 110.809 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.413 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 20.7 m -72.39 -42.2 65.47 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.679 -0.691 . . . . 71.32 110.577 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.419 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.7 m0 -56.29 -25.21 47.53 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 114.258 1.207 . . . . 75.32 114.258 -170.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.44 -39.48 46.67 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.672 0.272 . . . . 55.31 110.981 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -67.37 -47.73 69.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.656 0.782 . . . . 74.01 110.181 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 132' ' ' SER . 13.7 mm-40 -57.45 -63.04 1.37 Allowed 'General case' 0 C--N 1.355 0.809 0 CA-C-N 114.412 -1.267 . . . . 73.15 110.636 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -56.21 -38.66 71.31 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.736 1.272 . . . . 74.21 112.66 -176.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.417 ' HA ' HD11 ' A' ' 96' ' ' ILE . 6.4 tp-100 -58.18 -60.42 3.78 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.085 0.865 . . . . 75.42 110.43 178.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -68.73 -39.63 80.27 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.562 -0.745 . . . . 73.1 111.362 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.93 -57.98 10.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.929 1.692 . . . . 72.51 110.029 -177.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.404 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -75.29 -25.03 57.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 114.226 -1.352 . . . . 74.12 112.252 -174.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 95' ' ' LYS . 22.0 t70 -61.09 -56.05 25.38 Favored 'General case' 0 C--N 1.349 0.58 0 O-C-N 123.724 0.64 . . . . 72.11 109.315 172.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.84 -33.36 75.8 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.488 1.117 . . . . 74.3 111.695 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 25.5 t0 -74.15 -32.63 63.22 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.197 0.311 . . . . 74.23 111.114 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -67.07 -37.05 83.31 Favored 'General case' 0 C--N 1.355 0.81 0 N-CA-C 109.222 -0.658 . . . . 73.44 109.222 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 10.8 mmt180 -63.77 -44.1 94.42 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.558 -0.534 . . . . 73.53 109.558 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.93 74.59 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.716 0.806 . . . . 72.33 111.862 -176.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.461 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -76.47 -61.65 1.89 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 109.842 -0.429 . . . . 65.01 109.842 178.926 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -68.82 -33.04 73.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.62 0.768 . . . . 73.25 111.173 -170.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.9 ttm -117.18 80.28 1.46 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.537 -1.282 . . . . 45.2 107.537 171.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.535 HD11 ' HA ' ' A' ' 155' ' ' ASN . 26.1 tp -84.36 69.12 10.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 122.115 0.96 . . . . 71.45 108.479 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.78 48.6 1.43 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 105.883 -1.895 . . . . 72.1 105.883 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -125.62 4.22 7.53 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.558 -1.656 . . . . 71.11 109.081 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 55.46 27.98 10.97 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.392 1.077 . . . . 63.32 111.416 -169.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.535 ' HA ' HD11 ' A' ' 151' ' ' LEU . 17.6 t-20 74.36 -25.88 0.2 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.04 1.336 . . . . 73.33 114.245 171.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 . . . . . 0 CA--C 1.559 1.316 0 C-N-CA 125.226 1.411 . . . . 72.31 110.614 -170.134 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttp . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.555 0.693 . . . . 73.51 109.501 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -66.85 -44.06 82.0 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.74 0.816 . . . . 61.4 110.583 -173.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.548 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 59.9 m-20 -56.38 -53.86 52.39 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 124.059 0.85 . . . . 74.03 110.784 175.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.7 mt -56.57 -46.36 80.82 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.999 0.812 . . . . 74.03 111.804 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -54.79 -47.61 73.77 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.618 0.574 . . . . 73.41 110.707 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -69.46 -42.17 75.24 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 118.826 -0.607 . . . . 75.35 112.415 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.08 -43.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 123.829 0.852 . . . . 62.22 110.514 -177.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 29.5 mm -67.69 -42.84 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.029 -0.987 . . . . 61.4 110.471 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.2 m -60.68 -48.98 79.34 Favored 'General case' 0 C--N 1.357 0.91 0 O-C-N 123.523 0.515 . . . . 61.33 110.539 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -55.12 -49.97 70.42 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 123.995 0.918 . . . . 75.31 110.119 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.96 -48.45 79.01 Favored Glycine 0 C--N 1.343 0.92 0 O-C-N 124.844 1.34 . . . . 74.24 112.973 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.1 mt-30 -62.44 -49.38 75.68 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.799 0.44 . . . . 73.03 111.284 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.9 -34.92 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.891 0.877 . . . . 62.3 110.764 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.473 HD11 ' O ' ' A' ' 69' ' ' LEU . 8.6 mt -62.92 -48.27 88.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.824 1.25 . . . . 71.2 110.505 177.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -62.76 -36.58 83.51 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 123.994 0.809 . . . . 63.23 110.355 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.8 mmmt -66.24 -48.17 71.4 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.669 0.605 . . . . 62.21 112.083 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -77.66 -17.99 57.16 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.346 0.258 . . . . 73.43 111.646 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' SG ' HD23 ' A' ' 31' ' ' LEU . 53.0 t -71.33 -22.24 61.94 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.58 0.752 . . . . 71.44 111.031 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.48 -16.69 64.31 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.722 0.409 . . . . 73.43 111.3 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -68.62 -17.18 64.06 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.124 0.57 . . . . 74.32 112.325 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.494 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 5.7 mmt -76.74 83.29 3.35 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.596 -0.52 . . . . 72.22 109.596 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -40.97 72.75 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.703 -1.221 . . . . 73.43 107.703 174.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -92.77 154.53 18.23 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.239 -1.346 . . . . 73.32 108.543 170.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 144' ' ' ASP . 80.9 m 58.97 58.83 3.02 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.977 0.894 . . . . 50.25 109.344 -171.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -73.36 -34.39 65.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 114.199 -1.364 . . . . 71.52 111.472 -169.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -81.74 -27.66 33.72 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.047 -0.723 . . . . 52.21 109.047 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.661 ' HG3' ' HG ' ' A' ' 97' ' ' LEU . 27.4 mm-40 -61.28 -40.65 94.92 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.423 0.689 . . . . 65.12 110.537 165.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 42.5 t -65.55 -36.17 83.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.692 0.797 . . . . 51.53 110.982 176.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -71.97 -31.95 66.78 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.207 0.603 . . . . 60.24 110.92 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.483 ' CZ ' ' HB3' ' A' ' 136' ' ' GLU . 21.5 mmt180 -69.14 -52.33 29.22 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.782 0.433 . . . . 64.05 110.373 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.442 HD23 ' SG ' ' A' ' 18' ' ' CYS . 29.7 tp -65.3 -38.85 91.49 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.62 0.575 . . . . 71.53 110.243 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.87 -54.41 38.2 Favored Glycine 0 C--N 1.346 1.111 0 O-C-N 123.691 0.619 . . . . 73.25 112.915 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -64.6 -44.37 90.83 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.848 0.859 . . . . 71.13 110.781 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.492 ' HG2' ' CE2' ' A' ' 133' ' ' TRP . 39.5 mtm180 -57.78 -60.6 3.45 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.084 0.865 . . . . 73.02 110.406 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.09 -51.58 69.08 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.576 0 O-C-N 124.311 1.007 . . . . 50.1 112.1 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.6 -45.65 93.21 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 118.064 0.393 . . . . 74.42 111.01 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -73.18 -18.36 79.19 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.943 -0.571 . . . . 71.42 113.448 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 12.6 tp -87.35 -40.01 14.82 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.52 0.728 . . . . 75.42 111.124 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.415 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 11.8 pt -79.73 -34.56 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 119.058 -0.496 . . . . 74.33 110.361 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -53.68 -50.64 82.34 Favored Pre-proline 0 CA--C 1.562 1.414 0 CA-C-O 117.929 -1.034 . . . . 75.02 113.415 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.64 -39.84 78.96 Favored 'Trans proline' 0 C--N 1.4 3.265 0 C-N-CA 121.699 1.6 . . . . 74.44 112.265 177.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 45' ' ' LEU . 4.0 mm? -69.48 -31.99 70.61 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.62 -0.718 . . . . 61.52 111.072 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 52.6 mt-10 -70.31 -38.9 75.05 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.065 0.546 . . . . 73.23 111.153 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.0 mtm -61.77 -46.13 90.92 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 123.625 0.578 . . . . 53.03 111.47 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 42' ' ' LEU . 3.7 pp -75.25 -33.06 61.25 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 116.323 -0.399 . . . . 75.23 111.007 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.7 -32.95 74.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.148 0.579 . . . . 74.22 110.572 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.65 -45.37 59.28 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.936 0.894 . . . . 74.41 111.902 -179.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -100.53 -51.67 3.55 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 111.91 0.337 . . . . 71.45 111.91 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.89 70.77 3.07 Favored Glycine 0 C--N 1.345 1.042 0 N-CA-C 111.971 -0.452 . . . . 72.33 111.971 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -84.66 65.67 9.17 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.863 0.865 . . . . 65.44 109.579 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 78.0 mtp180 -92.22 156.95 16.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.963 0.905 . . . . 71.31 111.328 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.0 m -106.96 -163.71 0.93 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.967 0.907 . . . . 70.35 109.85 173.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 p 38.75 75.06 0.59 Allowed Pre-proline 0 CA--C 1.569 1.693 0 C-N-CA 126.014 1.726 . . . . 74.43 113.762 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -81.6 151.31 17.1 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.713 2.275 . . . . 74.22 111.763 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.524 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 28.9 m -66.25 152.89 43.94 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.252 0.621 . . . . 74.1 111.033 176.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -61.07 -45.28 95.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.128 0.571 . . . . 64.22 111.111 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -59.08 -41.38 87.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.088 0.555 . . . . 75.4 110.878 176.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 55' ' ' SER . 12.2 tp -65.53 -48.77 71.34 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.641 -1.163 . . . . 74.14 110.151 -172.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.2 m -67.28 -39.27 86.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 114.915 -1.039 . . . . 71.11 111.05 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.9 m -65.62 -36.9 85.05 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.145 0.578 . . . . 64.14 111.256 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.28 -45.51 84.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.186 0.595 . . . . 74.21 109.774 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.548 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.8 mmt -68.71 -20.87 64.42 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.034 -0.985 . . . . 72.21 112.327 176.217 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -74.62 -42.86 57.85 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.242 0.617 . . . . 70.13 109.905 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.15 -41.5 98.34 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.287 0.635 . . . . 74.3 109.827 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.412 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -64.9 -50.99 64.34 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.396 -1.274 . . . . 65.43 109.75 -177.023 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -53.62 -49.37 67.99 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.311 1.044 . . . . 64.1 110.357 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.76 80.11 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.315 1.009 . . . . 72.25 111.773 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.59 -43.04 85.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.303 0.641 . . . . 61.4 110.862 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -70.36 -25.82 63.44 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.365 0.666 . . . . 75.35 111.559 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -65.25 -50.45 65.73 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.078 0.466 . . . . 55.3 109.949 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -64.61 -38.96 92.8 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 114.96 -1.018 . . . . 60.32 110.746 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.72 -47.33 85.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.082 0.553 . . . . 70.53 110.904 176.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.67 -38.46 81.55 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.155 0.91 . . . . 73.31 110.814 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.36 -42.04 75.79 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 123.962 0.789 . . . . 62.41 113.118 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.08 -41.59 94.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 122.605 0.362 . . . . 71.34 111.073 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 4.3 pt -80.76 -18.5 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.502 0.556 . . . . 63.52 112.502 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -64.68 -33.69 76.54 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.127 -0.694 . . . . 71.43 109.127 165.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -76.75 -39.53 51.44 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.754 -0.657 . . . . 71.3 110.894 173.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.518 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.4 m-30 -74.11 -12.4 60.59 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 112.867 0.692 . . . . 72.42 112.867 -177.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.2 p -61.0 -31.12 70.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.024 0.44 . . . . 64.32 110.276 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -89.65 115.87 27.35 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.179 -1.045 . . . . 74.5 108.179 167.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -74.35 -25.13 59.34 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.784 0.834 . . . . 72.32 110.992 -172.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -68.71 -34.45 75.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.628 0.771 . . . . 71.01 110.31 174.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.9 -35.54 74.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.398 0.679 . . . . 72.22 110.359 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.5 mt -58.65 -58.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 N-CA-C 108.827 -0.805 . . . . 73.52 108.827 171.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.0 t -53.0 -37.98 61.92 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.005 0.922 . . . . 41.0 111.825 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -62.6 -52.26 64.07 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-N 115.123 -0.944 . . . . 75.04 111.266 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -28.94 64.41 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.146 -0.316 . . . . 74.31 110.146 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 145' ' ' ARG . 11.5 tp -74.81 -39.36 61.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.695 1.198 . . . . 72.42 111.524 -166.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -67.22 -22.94 65.69 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.235 -0.893 . . . . 64.14 110.661 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.3 -10.2 17.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.509 0.724 . . . . 64.13 112.149 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 92.2 p -71.08 125.2 26.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.682 0.393 . . . . 73.14 110.139 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -74.43 -35.09 63.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.216 0.606 . . . . 70.1 110.172 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -83.86 170.8 13.71 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.749 0.785 . . . . 73.42 110.884 169.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.461 ' HA ' ' HG3' ' A' ' 145' ' ' ARG . 89.4 mttt -105.44 -29.01 10.49 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.436 -1.256 . . . . 71.22 110.263 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.483 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.5 mp -74.76 126.89 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 108.593 -0.892 . . . . 53.33 108.593 -176.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.661 ' HG ' ' HG3' ' A' ' 27' ' ' GLN . 15.5 mt -65.19 -38.98 92.2 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 122.173 0.987 . . . . 75.44 110.093 177.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 56.7 m-85 -107.07 43.86 1.12 Allowed 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 113.715 -1.584 . . . . 71.31 109.445 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -63.46 -64.81 0.8 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.357 -0.979 . . . . 73.55 108.357 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.74 -42.82 85.65 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.785 -1.098 . . . . 74.34 110.302 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.49 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 50.0 t -59.65 -54.74 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 124.149 0.906 . . . . 73.13 111.278 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.406 HD21 ' HB3' ' A' ' 133' ' ' TRP . 65.2 t30 -72.07 -25.82 61.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 119.186 -0.435 . . . . 74.24 110.727 -176.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -61.0 -43.93 98.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 109.815 -0.439 . . . . 75.11 109.815 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.49 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 42.5 mttm -60.36 -57.45 12.72 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.902 0.881 . . . . 72.44 110.744 175.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.2 mp -54.6 -41.0 69.43 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.9 0.75 . . . . 75.12 111.348 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.2 t -71.64 -42.11 67.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.346 0.658 . . . . 43.54 111.264 -176.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 17.7 t70 -71.93 -44.96 62.77 Favored 'General case' 0 C--O 1.254 1.305 0 O-C-N 123.623 0.577 . . . . 63.1 110.718 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.7 t -58.57 -49.74 81.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 CA-C-N 115.003 -0.999 . . . . 72.22 109.173 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -64.16 -29.07 70.21 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.011 0.819 . . . . 71.52 111.83 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.731 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 40.8 mtpt -56.69 -67.69 0.29 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 108.54 -0.911 . . . . 63.43 108.54 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.16 -29.84 71.11 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 124.084 0.865 . . . . 71.44 111.902 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.3 tt -72.52 -50.21 27.38 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.622 0.769 . . . . 74.42 110.142 -175.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.4 p -62.08 -37.6 85.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.446 0.298 . . . . 51.32 110.689 177.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 94.1 mt -60.11 -44.62 94.72 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.372 -0.831 . . . . 74.42 111.701 176.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -78.49 -21.8 48.43 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 112.23 0.456 . . . . 64.44 112.23 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 84.7 mt -63.97 -43.19 96.53 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.918 -0.771 . . . . 61.12 108.918 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 16.8 mm-40 -68.69 -47.47 66.34 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.698 0.799 . . . . 51.24 112.269 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.2 t -64.19 -60.65 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.23 0.612 . . . . 73.32 111.372 -177.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -86.32 -54.47 4.42 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.797 -0.638 . . . . 62.34 111.37 -168.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -88.37 -6.27 57.81 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.503 0.557 . . . . 74.45 112.503 -175.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 52.7 ttt85 66.16 7.57 4.91 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.854 1.262 . . . . 72.22 112.771 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 37.1 mtp -65.46 118.34 49.63 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.258 1.023 . . . . 65.52 111.423 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -81.82 51.61 3.9 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.612 2.874 . . . . 71.14 112.559 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.13 105.68 11.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.731 0.813 . . . . 75.34 109.882 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.0 t -148.24 68.12 10.16 Favored Pre-proline 0 CA--C 1.55 0.96 0 CA-C-N 115.753 -0.658 . . . . 41.52 110.013 176.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.61 7.85 4.96 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.567 2.178 . . . . 72.34 112.563 177.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.42 HD13 ' HA2' ' A' ' 130' ' ' GLY . 17.8 tt -147.21 -31.0 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 124.169 0.988 . . . . 75.13 110.236 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 19.7 m 73.04 -65.93 0.33 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.415 1.486 . . . . 52.42 112.316 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -72.34 -67.68 0.53 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.021 0.528 . . . . 72.22 111.435 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.42 ' HA2' HD13 ' A' ' 127' ' ' ILE . . . 90.38 -29.8 6.42 Favored Glycine 0 N--CA 1.48 1.568 0 N-CA-C 112.666 -0.173 . . . . 73.32 112.666 -176.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.03 -13.36 60.23 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.4 1.08 . . . . 52.35 111.306 172.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.5 m -46.4 -40.17 11.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.125 1.37 . . . . 74.25 112.338 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.492 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 37.3 m0 -60.28 -32.64 71.37 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 114.653 -1.158 . . . . 72.33 113.141 -177.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.46 -27.97 69.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.749 0.42 . . . . 64.03 111.612 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -88.81 -46.6 8.83 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.636 0.774 . . . . 62.21 110.705 174.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 49.8 mt-10 -64.11 -62.56 1.55 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.152 0.981 . . . . 72.22 111.6 -174.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -53.84 -34.07 58.18 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.871 0.869 . . . . 72.24 111.895 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -67.13 -52.04 46.56 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.109 0.564 . . . . 73.24 112.216 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.74 -48.69 80.67 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.556 0.535 . . . . 64.43 109.902 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.47 -38.31 86.8 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 114.248 -1.342 . . . . 64.23 110.313 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.0 97.6 Favored 'General case' 0 C--O 1.22 -0.46 0 O-C-N 124.121 0.888 . . . . 51.44 112.374 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.33 -47.78 84.36 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 109.181 -0.674 . . . . 74.15 109.181 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.93 -48.25 82.13 Favored 'General case' 0 CA--C 1.555 1.141 0 O-C-N 124.389 1.055 . . . . 74.11 111.35 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 24' ' ' CYS . 64.3 m-20 -70.33 -56.11 7.51 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.079 0.952 . . . . 62.43 112.378 -176.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.513 ' HG2' HD11 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -62.11 -43.07 99.65 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.318 1.047 . . . . 72.32 109.738 -173.696 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -63.45 -49.76 72.4 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 123.971 0.794 . . . . 75.43 109.632 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.73 70.71 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 112.312 0.486 . . . . 71.12 112.312 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -45.62 60.27 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.31 0.644 . . . . 70.42 109.555 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -76.51 -13.25 60.11 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 115.754 -0.657 . . . . 75.13 112.096 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 48.8 mtm -97.57 -77.59 0.5 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.084 -0.709 . . . . 63.53 109.084 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 95.8 mt 61.63 178.69 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.907 1.283 . . . . 53.34 111.663 -172.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -166.33 42.7 0.06 Allowed 'General case' 0 N--CA 1.484 1.229 0 CA-C-O 121.572 0.701 . . . . 65.5 110.862 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -136.19 -59.56 0.74 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.865 0.866 . . . . 71.44 109.766 175.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -122.12 28.73 7.36 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.184 0.994 . . . . 63.4 109.857 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -107.27 130.02 54.81 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.764 0.826 . . . . 73.34 109.924 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 . . . . . 0 CA--C 1.554 1.129 0 C-N-CA 124.194 0.998 . . . . 73.11 109.004 173.378 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.3 ttp . . . . . 0 N--CA 1.496 1.873 0 CA-C-O 120.878 0.371 . . . . 70.11 110.197 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -30.05 34.28 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.902 0.881 . . . . 75.32 111.515 171.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -55.42 -45.05 76.75 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.857 0.863 . . . . 64.22 110.535 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.12 -41.53 94.77 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.364 -0.834 . . . . 64.05 110.69 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -57.19 -43.4 82.63 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.746 0.654 . . . . 75.53 110.862 177.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.8 m80 -60.71 -55.71 29.95 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.619 0.574 . . . . 72.32 110.584 178.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.26 -49.39 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.817 0.847 . . . . 72.43 111.761 -177.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 80.5 mt -71.12 -43.59 75.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.708 1.203 . . . . 73.41 111.197 -172.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 13' ' ' VAL . 97.5 m -63.45 -48.88 75.89 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.697 0.399 . . . . 65.31 110.536 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.1 mt -53.71 -50.36 66.07 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.05 0.843 . . . . 75.15 110.471 177.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.69 -52.31 46.56 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 124.602 1.189 . . . . 73.51 112.996 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.69 -48.24 82.45 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.773 0.429 . . . . 64.24 111.463 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 9' ' ' THR . 46.5 t -68.34 -25.24 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.086 0.554 . . . . 73.41 111.061 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.489 HD11 ' O ' ' A' ' 69' ' ' LEU . 33.4 mt -64.43 -48.4 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.83 0.852 . . . . 70.4 109.181 172.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.469 ' HB2' HG11 ' A' ' 35' ' ' VAL . 38.9 t-80 -59.37 -37.71 78.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.404 0.681 . . . . 74.03 111.134 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -63.75 -59.02 5.1 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.804 0.69 . . . . 74.23 110.966 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -74.69 -16.82 60.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.063 0.545 . . . . 75.31 111.755 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.63 -23.22 65.32 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.365 0.666 . . . . 73.11 111.289 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.96 -8.52 53.7 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.165 0.586 . . . . 73.33 111.653 178.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.85 -23.27 67.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.597 0.359 . . . . 63.01 111.153 170.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 7.2 mmt -74.88 87.44 2.28 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.697 -0.853 . . . . 72.3 108.697 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -36.09 75.13 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 107.359 -1.348 . . . . 72.53 107.359 168.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -89.72 175.91 7.06 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.622 -1.172 . . . . 74.21 108.454 171.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.613 ' SG ' HG21 ' A' ' 85' ' ' ILE . 99.9 m 57.79 74.03 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.796 0.685 . . . . 61.23 110.405 -172.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.76 -60.44 3.09 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.731 1.212 . . . . 73.21 110.585 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.569 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 57.5 mmtt -63.67 -49.46 73.07 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 115.145 -0.934 . . . . 75.24 110.381 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 14.0 mt-30 -60.55 -34.91 74.83 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.1 0.56 . . . . 75.23 112.243 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.4 t -74.21 -44.43 53.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.619 0.368 . . . . 72.14 110.948 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -65.79 -38.82 90.05 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 122.713 0.405 . . . . 74.42 110.911 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' NH2' ' HA ' ' A' ' 137' ' ' ASP . 18.2 mtp180 -67.9 -38.47 83.01 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.123 0.969 . . . . 64.03 110.627 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER -60.05 -50.81 72.24 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.995 0.81 . . . . 73.32 108.91 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -40.2 97.31 Favored Glycine 0 C--N 1.348 1.211 0 O-C-N 123.971 0.795 . . . . 64.13 113.202 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -57.0 -47.76 80.05 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.35 1.06 . . . . 74.43 110.71 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.412 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 69.5 mtt-85 -64.68 -48.78 73.47 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 114.726 -1.124 . . . . 73.41 110.753 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.469 HG11 ' HB2' ' A' ' 15' ' ' HIS . 41.7 t -54.09 -61.62 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.518 0 O-C-N 124.148 0.905 . . . . 60.42 111.185 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.488 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 72.2 mt -65.39 -46.42 80.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.074 0.859 . . . . 61.51 110.564 -172.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -37.78 76.97 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 116.058 -0.519 . . . . 74.3 113.069 176.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 65' ' ' PHE . 18.0 tp -84.33 -38.13 20.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.853 0.861 . . . . 73.45 112.471 -173.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.437 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 16.3 pt -75.46 -37.45 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 119.42 -0.324 . . . . 74.2 110.871 -176.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' A' ' 36' ' ' LEU . 5.6 mptp? -51.7 -51.81 66.59 Favored Pre-proline 0 N--CA 1.485 1.296 0 N-CA-C 114.021 1.119 . . . . 75.11 114.021 -174.501 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 19.6 Cg_endo -55.43 -37.52 94.74 Favored 'Trans proline' 0 C--N 1.395 3.007 0 C-N-CA 122.357 2.038 . . . . 64.43 112.669 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 -40.77 76.19 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.377 0.671 . . . . 72.33 110.658 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 92.7 mt-10 -66.74 -37.13 84.04 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.405 1.082 . . . . 74.42 111.299 -179.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 34.6 mmt -65.76 -40.15 91.77 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.728 0.642 . . . . 64.31 110.431 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -76.82 -38.26 54.18 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.281 -0.418 . . . . 62.34 110.403 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -39.2 87.65 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.485 0.714 . . . . 54.42 111.67 -178.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -71.86 -40.79 68.74 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.866 0.866 . . . . 61.25 110.899 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -86.11 -61.13 1.82 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.079 -0.509 . . . . 72.24 111.138 -176.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 172.79 86.18 0.06 OUTLIER Glycine 0 C--N 1.337 0.628 0 N-CA-C 112.256 -0.338 . . . . 63.42 112.256 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -90.65 159.73 16.25 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.425 0.69 . . . . 53.41 109.813 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.645 ' HG3' HE21 ' A' ' 120' ' ' GLN . 41.1 mmt180 -47.76 96.37 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.222 1.409 . . . . 74.13 111.836 175.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.4 m -72.03 -43.29 65.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.634 -1.166 . . . . 71.54 109.655 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 t -113.72 89.68 16.51 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 107.758 -1.201 . . . . 75.31 107.758 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.47 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 36.4 Cg_endo -91.65 -167.56 0.21 Allowed 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 123.041 2.494 . . . . 75.44 112.587 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.3 m -83.83 166.24 18.12 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.217 0.607 . . . . 71.11 109.684 172.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -59.98 -38.29 82.12 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.958 0.503 . . . . 74.41 110.735 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HG3' HD22 ' A' ' 58' ' ' LEU . 61.8 pttt -62.42 -37.27 85.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.371 0.668 . . . . 55.24 111.626 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 115' ' ' LEU . 4.0 mm? -65.96 -51.12 61.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.674 0.39 . . . . 73.12 110.172 175.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.5 m -58.67 -45.42 89.42 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.11 0.881 . . . . 70.15 111.229 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 51.0 m -59.73 -44.89 93.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.875 0.87 . . . . 65.32 110.212 176.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.67 -44.44 96.47 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.706 0.629 . . . . 75.41 111.494 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.6 mmt -67.45 -31.47 71.66 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.82 0.848 . . . . 61.31 111.141 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -74.29 -44.9 50.78 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.677 0.791 . . . . 73.22 111.057 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -61.25 -44.2 97.63 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.768 0.827 . . . . 73.14 109.727 175.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.46 ' HE1' HD21 ' A' ' 38' ' ' LEU . 3.4 t80 -59.62 -58.13 9.93 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 113.533 -1.667 . . . . 51.11 109.958 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.9 ttpp -52.71 -45.53 66.93 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 124.6 1.187 . . . . 73.2 110.913 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.82 79.03 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 124.311 1.007 . . . . 70.53 111.785 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.15 -34.8 71.34 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.339 0.656 . . . . 72.01 111.737 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.489 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -63.84 -40.12 95.84 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 122.554 0.342 . . . . 63.1 110.737 170.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 37.5 mt-10 -63.4 -42.07 98.77 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.151 0.58 . . . . 73.05 110.413 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 39.1 mt-10 -58.26 -54.65 44.65 Favored 'General case' 0 C--N 1.355 0.837 0 CA-C-N 114.907 -1.042 . . . . 71.22 110.124 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.19 -43.67 78.67 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.569 1.168 . . . . 74.41 111.884 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.06 -51.64 68.48 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 124.68 1.237 . . . . 54.2 109.854 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.04 -31.31 80.48 Favored Glycine 0 CA--C 1.535 1.282 0 CA-C-N 115.036 -0.984 . . . . 71.21 114.171 178.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 29.8 mm-40 -67.65 -56.42 9.45 Favored 'General case' 0 C--N 1.356 0.879 0 CA-C-N 116.947 0.373 . . . . 74.35 110.396 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -59.29 -28.26 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.937 -0.477 . . . . 74.43 111.43 175.557 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.07 -46.52 89.31 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.037 0.384 . . . . 52.21 112.037 171.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 14.1 ptpt -73.77 -25.29 60.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 117.852 0.296 . . . . 60.43 110.87 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.58 -2.41 57.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.541 0.736 . . . . 74.35 112.851 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.9 p -57.13 -31.14 65.02 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.978 0.511 . . . . 74.44 111.189 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -83.83 115.51 22.28 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 107.913 -1.143 . . . . 63.52 107.913 165.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -74.3 -23.02 59.03 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.482 0.713 . . . . 63.4 111.083 -172.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.8 p -59.82 -32.34 70.56 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.071 0.948 . . . . 71.53 111.765 171.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -63.17 -42.28 99.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.423 0.689 . . . . 64.03 110.327 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.613 HG21 ' SG ' ' A' ' 24' ' ' CYS . 52.5 mt -59.63 -58.7 5.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 114.812 -1.086 . . . . 63.32 109.44 178.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.0 t -56.5 -35.6 68.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.153 0.581 . . . . 74.32 111.693 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -57.38 -58.32 8.78 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.426 1.09 . . . . 53.32 111.621 178.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.405 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 1.7 p90 -75.47 -34.7 60.93 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.779 -0.452 . . . . 72.32 109.779 -177.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 12.7 tp -66.32 -37.94 86.52 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.65 1.18 . . . . 75.25 111.503 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -66.67 -19.43 65.76 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.86 -0.609 . . . . 73.41 111.221 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.94 -23.0 14.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.101 0.96 . . . . 70.45 111.423 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.718 ' HB3' ' HB3' ' A' ' 95' ' ' LYS . 74.4 m -96.89 106.4 18.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.368 1.067 . . . . 63.24 110.721 -174.308 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -86.45 -45.25 11.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.603 0.761 . . . . 75.12 111.681 -173.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -124.5 -3.34 7.87 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.92 0.888 . . . . 74.51 111.105 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.718 ' HB3' ' HB3' ' A' ' 92' ' ' SER . 47.3 tptt -70.05 93.58 0.81 Allowed 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.694 -1.224 . . . . 71.24 107.694 170.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' A' ' 141' ' ' ALA . 14.1 mm -62.75 155.28 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 114.961 -1.018 . . . . 72.4 108.826 178.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.405 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 2.0 tp -50.54 -43.71 56.2 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.632 0.729 . . . . 75.31 111.582 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 3.5 m-85 -118.05 25.09 10.58 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 114.421 -1.263 . . . . 55.34 110.797 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -40.34 -56.95 1.87 Allowed 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 124.535 1.134 . . . . 63.4 112.559 -167.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.96 -55.32 8.59 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.184 0.993 . . . . 65.03 111.074 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.4 -46.1 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 124.29 1.036 . . . . 71.11 111.954 -174.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.412 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 51.0 t30 -76.38 -28.73 56.87 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.983 1.313 . . . . 73.13 110.407 -177.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -62.48 -39.4 93.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 109.85 -0.426 . . . . 71.41 109.85 168.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -68.39 -36.94 79.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.38 0.672 . . . . 64.4 110.464 175.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.84 -39.15 90.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.854 0.461 . . . . 72.01 110.777 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 66.1 m -72.6 -41.06 66.02 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.368 0.667 . . . . 71.12 111.209 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.497 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 15.9 t70 -80.1 -36.3 35.63 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.748 0.419 . . . . 70.44 110.599 -176.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.2 t -69.85 -28.78 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 110.084 -0.339 . . . . 63.34 110.084 172.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -69.43 -34.84 75.03 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 119.333 -0.365 . . . . 70.52 110.703 170.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 51.8 mtpt -57.22 -57.61 11.85 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 109.616 -0.513 . . . . 71.12 109.616 171.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.2 mt-10 -51.72 -47.18 64.09 Favored 'General case' 0 C--N 1.358 0.94 0 O-C-N 124.447 1.092 . . . . 72.55 110.415 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -64.08 -60.46 3.21 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 124.176 0.99 . . . . 72.4 109.965 -173.057 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -53.27 -38.94 63.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.065 0.946 . . . . 63.52 111.513 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 118' ' ' VAL . 96.6 mt -60.2 -62.78 1.61 Allowed 'General case' 0 CA--C 1.545 0.777 0 O-C-N 123.703 0.627 . . . . 65.33 111.149 175.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 58' ' ' LEU . 2.5 pp -65.9 -23.15 66.58 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.724 0.639 . . . . 72.23 112.724 -176.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.419 HD13 ' SD ' ' A' ' 122' ' ' MET . 80.8 mt -72.86 -42.28 63.84 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 123.483 0.713 . . . . 71.44 110.001 175.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -75.77 -26.01 56.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.506 0.322 . . . . 63.24 111.402 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 114' ' ' LEU . 77.8 t -75.25 -61.81 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.695 -0.483 . . . . 64.32 109.695 177.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -59.02 2.37 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.977 0.511 . . . . 75.31 110.066 -170.196 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.645 HE21 ' HG3' ' A' ' 51' ' ' ARG . 27.8 mp0 -76.85 -14.09 59.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.241 0.616 . . . . 74.4 111.569 -174.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 63.65 22.84 13.3 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 124.884 1.274 . . . . 75.44 111.04 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.528 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 48.6 ttm -55.45 115.41 9.24 Favored Pre-proline 0 C--N 1.357 0.894 0 C-N-CA 124.654 1.182 . . . . 71.54 111.999 -173.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.47 91.98 1.16 Allowed 'Trans proline' 0 C--N 1.367 1.502 0 C-N-CA 122.108 1.872 . . . . 61.4 109.72 172.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 m -67.04 88.03 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 CA-C-O 122.32 1.057 . . . . 65.42 109.954 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 37.1 m -97.05 -48.35 0.23 Allowed Pre-proline 0 CA--C 1.563 1.467 0 CA-C-N 114.313 -1.312 . . . . 74.01 112.21 -176.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.36 -12.68 34.21 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.823 1.682 . . . . 74.1 112.998 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 14.9 tt -148.84 155.67 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.929 0.892 . . . . 53.41 109.061 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.1 t -104.35 -165.91 1.19 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.442 0.697 . . . . 61.22 109.638 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -57.81 -40.5 80.12 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.899 0.88 . . . . 73.34 111.88 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 120.44 37.63 0.72 Allowed Glycine 0 C--N 1.345 1.033 0 CA-C-N 115.963 -0.562 . . . . 71.55 112.275 -177.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.67 87.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.327 0.651 . . . . 63.33 109.501 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 35.7 t -60.01 -35.96 76.18 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 114.782 -1.099 . . . . 61.53 110.913 173.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.404 ' HH2' HD22 ' A' ' 38' ' ' LEU . 11.3 m0 -68.52 -17.26 64.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.428 1.091 . . . . 75.31 113.286 -171.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.52 -40.76 18.76 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.781 -0.574 . . . . 70.21 110.721 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -73.35 -39.05 65.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.989 -1.005 . . . . 71.4 111.481 -171.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' ' 140' ' ' ASP . 41.7 mt-10 -52.59 -56.82 12.63 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 124.917 1.287 . . . . 75.14 111.068 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.498 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 3.5 m-20 -63.5 -57.64 9.57 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.031 -0.986 . . . . 74.1 112.368 -172.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -59.23 -58.89 6.66 Favored 'General case' 0 CA--C 1.561 1.404 0 O-C-N 123.062 0.226 . . . . 75.51 111.406 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.82 -56.19 6.87 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 122.36 0.264 . . . . 74.2 110.63 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 136' ' ' GLU . 5.5 m-20 -74.99 -28.84 60.7 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.299 -0.858 . . . . 71.43 112.254 -170.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.501 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -78.89 -24.44 44.2 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.655 1.116 . . . . 74.13 110.967 176.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -65.84 -47.03 76.37 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 109.745 -0.465 . . . . 75.14 109.745 167.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.69 -39.66 77.66 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.952 0.901 . . . . 64.1 110.781 175.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 29.8 t0 -75.02 -42.93 56.32 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.198 0.999 . . . . 71.1 111.906 -172.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 61.6 ttt-85 -64.7 -41.7 95.83 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.1 -0.954 . . . . 71.14 109.719 178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -65.09 -34.9 79.51 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.186 -0.915 . . . . 71.32 110.806 172.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.56 -19.56 59.22 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.855 0.462 . . . . 73.52 111.491 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.63 -58.79 3.06 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.866 -0.79 . . . . 64.03 108.866 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -70.14 -46.72 64.13 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.587 0.755 . . . . 54.01 111.494 -175.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 75.3 mtp -96.86 36.25 1.43 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.572 0.749 . . . . 72.34 110.397 -178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.7 111.87 2.27 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.703 0.801 . . . . 65.14 110.702 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -99.29 16.67 22.21 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.065 0.546 . . . . 60.42 110.763 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.07 105.62 11.19 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.802 -0.814 . . . . 73.02 108.802 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 65.17 13.67 8.89 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.975 1.31 . . . . 74.04 113.147 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -99.88 148.22 24.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.874 0.869 . . . . 64.42 109.233 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 . . . . . 0 CA--C 1.557 1.241 0 C-N-CA 124.804 1.241 . . . . 70.11 110.845 -178.206 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.597 0.237 . . . . 75.1 110.566 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.23 -52.79 9.3 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.079 0.551 . . . . 75.14 110.553 178.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -61.07 -41.01 95.83 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.885 0.74 . . . . 71.54 109.484 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.425 HD11 HD12 ' A' ' 42' ' ' LEU . 3.6 mm? -58.17 -52.11 66.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.303 0.641 . . . . 75.34 110.409 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -53.85 -38.67 64.91 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.135 0.574 . . . . 72.31 111.083 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.417 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.5 t-80 -65.88 -49.5 67.85 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 123.805 0.691 . . . . 75.3 110.49 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.96 -52.58 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 124.876 1.27 . . . . 71.21 111.477 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -64.71 -40.87 90.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.035 0.934 . . . . 70.34 110.693 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 55.3 m -62.75 -42.5 99.71 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.693 0.397 . . . . 72.22 110.75 176.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 79.6 mt -57.4 -56.65 19.09 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.37 0.419 . . . . 72.12 110.084 177.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.4 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -62.58 -35.7 92.18 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 124.279 0.987 . . . . 63.11 113.827 -176.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.447 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 4.5 tp-100 -70.38 -49.5 48.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 109.636 -0.505 . . . . 74.13 109.636 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.99 -33.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.564 0.746 . . . . 72.02 110.774 175.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.4 HD12 ' HA2' ' A' ' 11' ' ' GLY . 23.1 mt -54.61 -55.96 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.949 0.9 . . . . 64.5 109.768 173.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -60.39 -38.7 84.79 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 124.155 0.909 . . . . 71.42 111.686 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 13.5 mptt -60.84 -54.64 42.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.008 0.923 . . . . 63.23 111.918 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -79.48 -19.22 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.461 0.704 . . . . 62.22 111.989 -175.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.6 t -64.33 -17.81 64.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.365 1.066 . . . . 75.41 113.068 177.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -55.42 -20.63 12.82 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 123.961 0.905 . . . . 72.31 112.915 175.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -62.8 -29.87 71.04 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.408 0.683 . . . . 73.31 112.472 175.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.422 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 8.3 mmt -78.45 81.83 4.76 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.101 0.477 . . . . 44.11 110.679 -173.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -80.55 -34.51 35.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.139 -1.06 . . . . 60.32 108.139 169.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.45 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 85.7 m-85 -90.81 153.32 20.32 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 114.186 -1.37 . . . . 71.42 108.217 170.099 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m 57.81 70.99 0.61 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.369 1.08 . . . . 53.53 109.536 -166.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' H ' ' HD2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -75.08 -48.69 22.65 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 113.803 -1.544 . . . . 53.43 109.411 -170.559 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.0 mptp? -61.68 -37.37 83.84 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 109.416 -0.587 . . . . 75.21 109.416 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.77 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 16.0 mm-40 -66.25 -43.85 85.37 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 117.862 0.301 . . . . 51.33 111.16 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 52.7 t -66.78 -43.02 85.08 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.906 0.882 . . . . 73.12 111.874 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.3 mpt_? -80.93 -33.55 33.97 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.557 0.743 . . . . 72.43 111.033 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.511 ' NH2' ' HB2' ' A' ' 136' ' ' GLU . 25.6 tpt180 -73.16 -38.63 66.15 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.185 -0.672 . . . . 51.0 109.185 176.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.73 -46.33 90.11 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 123.815 0.697 . . . . 74.12 109.159 173.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.2 -46.22 93.07 Favored Glycine 0 C--N 1.349 1.298 0 O-C-N 123.879 0.737 . . . . 54.44 112.63 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -60.46 -52.82 63.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.453 0.701 . . . . 52.01 110.452 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.54 HH12 ' HB2' ' A' ' 106' ' ' SER . 16.3 mtt180 -58.81 -63.4 1.31 Allowed 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.094 0.871 . . . . 60.15 110.547 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 39' ' ' ILE . 55.8 t -50.93 -50.57 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.305 1.042 . . . . 70.05 111.942 -175.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -62.46 -41.54 98.83 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 123.369 0.418 . . . . 71.25 111.188 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.55 -23.55 72.12 Favored Glycine 0 N--CA 1.474 1.17 0 CA-C-N 116.325 -0.398 . . . . 61.5 113.34 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.571 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 27.6 mt -87.2 -46.98 9.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 54.2 111.301 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 35' ' ' VAL . 23.0 pt -80.47 -41.55 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 117.933 -1.032 . . . . 64.34 111.917 -170.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -54.77 -48.27 95.97 Favored Pre-proline 0 N--CA 1.497 1.891 0 N-CA-C 113.724 1.009 . . . . 75.43 113.724 -174.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -54.76 -39.36 89.94 Favored 'Trans proline' 0 C--N 1.391 2.785 0 C-N-CA 122.1 1.866 . . . . 61.33 112.868 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 45' ' ' LEU . 4.2 mm? -77.08 -29.39 54.97 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.224 -0.898 . . . . 75.21 111.359 178.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -67.22 -38.14 84.76 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.323 0.649 . . . . 62.03 109.973 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 67.3 mtm -62.07 -50.77 70.65 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.779 0.675 . . . . 75.02 111.019 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 42' ' ' LEU . 4.4 pp -76.51 -22.77 54.0 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.698 0.399 . . . . 65.33 111.967 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -71.24 -41.15 70.51 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.608 0.763 . . . . 72.45 110.211 174.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -73.17 -43.73 61.02 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.909 0.884 . . . . 75.42 108.882 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -61.02 -47.71 85.17 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.028 1.331 . . . . 71.45 110.096 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 54.3 38.11 61.23 Favored Glycine 0 C--N 1.35 1.326 0 O-C-N 124.881 1.363 . . . . 40.32 115.069 173.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -86.95 77.65 9.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 122.659 0.384 . . . . 63.34 110.512 -175.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 45.04 70.44 0.35 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.607 1.563 . . . . 75.14 113.017 169.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -87.58 126.28 34.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.937 0.495 . . . . 75.42 110.21 -176.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.3 t -80.64 118.42 72.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 123.493 0.717 . . . . 74.43 109.361 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -78.2 165.84 25.3 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.492 2.128 . . . . 73.31 111.774 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.1 t -150.08 153.96 37.31 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.12 -1.066 . . . . 61.33 108.12 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -62.74 -44.73 95.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 122.495 0.318 . . . . 71.01 110.875 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.86 -37.28 76.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.388 0.675 . . . . 64.04 111.147 175.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 2.8 tm? -70.94 -47.66 57.77 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 124.11 0.964 . . . . 64.24 109.392 -175.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.3 m -64.46 -40.57 95.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.08 0.862 . . . . 43.24 110.857 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.8 m -58.52 -49.11 78.58 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.788 0.835 . . . . 73.15 110.756 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.09 98.64 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.722 0.809 . . . . 53.13 111.0 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.6 mmt -67.84 -33.62 75.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.668 0.787 . . . . 74.12 111.14 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -73.27 -35.88 66.26 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.544 0.737 . . . . 64.35 110.751 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.278 0.631 . . . . 61.43 110.112 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.571 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 2.5 t80 -67.17 -45.91 75.56 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.116 1.366 . . . . 70.11 109.507 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.2 ttpp -58.32 -51.29 70.4 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.812 -1.54 . . . . 72.03 110.009 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.72 -43.2 76.3 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.177 0.923 . . . . 52.32 111.392 -178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.572 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.8 -42.63 99.26 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 114.984 -1.007 . . . . 74.51 111.639 177.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -74.41 -25.8 59.68 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.931 0.492 . . . . 72.33 112.3 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 62.1 mt-10 -67.11 -44.04 80.95 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.619 0.724 . . . . 64.22 109.341 174.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.1 mt-10 -67.53 -43.18 81.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.509 -1.223 . . . . 62.24 111.01 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.57 -40.26 96.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.466 0.707 . . . . 62.2 111.23 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.42 -43.43 98.88 Favored 'General case' 0 C--N 1.351 0.64 0 O-C-N 124.235 0.959 . . . . 75.1 109.758 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.2 -33.34 86.98 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.555 -0.748 . . . . 62.34 113.89 175.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 26.0 mm-40 -63.69 -57.94 8.45 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.998 -0.371 . . . . 73.14 109.998 178.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.563 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -66.7 -20.13 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.62 0.6 . . . . 74.3 112.62 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.74 -49.56 75.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.104 -0.702 . . . . 72.23 109.104 171.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -80.83 -25.97 37.36 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 111.811 0.3 . . . . 74.14 111.811 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.563 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.7 m-30 -77.81 -5.21 50.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.595 0.758 . . . . 74.32 112.131 -178.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.8 p -55.91 -30.71 62.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.244 0.617 . . . . 74.42 110.178 173.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -81.76 107.55 14.58 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 108.657 -0.868 . . . . 62.43 108.657 167.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -68.26 -25.82 65.36 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.345 0.658 . . . . 75.2 110.749 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.7 p -71.23 -33.02 69.47 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 43.15 111.336 175.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.95 -40.57 98.08 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.566 0.746 . . . . 65.23 110.047 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.65 HG23 HD11 ' A' ' 97' ' ' LEU . 32.3 mt -57.87 -61.25 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.846 0 CA-C-N 114.83 -1.077 . . . . 73.23 109.911 175.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.99 -40.57 61.15 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.976 0.91 . . . . 72.24 111.971 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 47.3 tpt85 -58.92 -56.68 19.11 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.449 -1.25 . . . . 63.21 111.754 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -21.27 51.66 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 110.219 -0.289 . . . . 71.33 110.219 -177.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.505 HD23 HE22 ' A' ' 149' ' ' GLN . 17.3 tp -73.3 -40.81 64.24 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.932 0.893 . . . . 72.01 110.576 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -67.11 -23.92 65.88 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.026 0.441 . . . . 53.54 110.607 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.33 -0.26 41.5 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.591 1.156 . . . . 71.24 111.8 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.6 t -66.55 131.05 45.18 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.279 0.632 . . . . 53.02 110.369 -176.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -81.78 -7.8 59.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.763 0.825 . . . . 64.42 111.294 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.36 -175.46 4.0 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.706 0.802 . . . . 52.05 110.158 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 -45.96 10.22 Favored 'General case' 0 C--O 1.242 0.689 0 C-N-CA 123.763 0.825 . . . . 72.11 110.909 178.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.6 HD13 ' HG2' ' A' ' 99' ' ' LYS . 3.1 mp -76.3 131.59 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 123.759 0.662 . . . . 74.33 109.825 -168.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.77 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.9 tp -62.97 -39.75 95.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.237 1.015 . . . . 74.31 111.096 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.403 ' H ' HG22 ' A' ' 96' ' ' ILE . 39.1 m-85 -103.56 17.74 23.42 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 114.354 -1.294 . . . . 72.42 111.016 -175.656 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 96' ' ' ILE . 2.1 tmtp? -35.45 -64.27 0.3 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 124.78 1.232 . . . . 74.52 113.571 -157.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 25.8 t70 -61.82 -48.84 78.77 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 124.044 0.84 . . . . 54.53 110.797 -175.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.19 -44.95 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.85 . . . . 74.32 111.268 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -75.43 -25.93 57.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.599 0.76 . . . . 72.12 110.221 -175.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.65 -38.64 89.91 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.827 -0.805 . . . . 74.24 108.827 170.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 100' ' ' ASP . 1.4 mptm? -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 118.855 -0.593 . . . . 72.04 110.846 172.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.5 mp -58.12 -43.76 87.38 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 119.275 0.943 . . . . 74.14 110.389 172.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.54 ' HB2' HH12 ' A' ' 34' ' ' ARG . 9.5 t -67.33 -51.62 50.16 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.421 0.688 . . . . 70.52 111.256 -175.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 14.0 t70 -69.26 -50.02 50.81 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.531 -1.213 . . . . 73.02 110.11 -174.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.56 -35.95 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 118.944 -0.55 . . . . 75.03 110.806 -178.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.54 ' HH2' HG12 ' A' ' 124' ' ' VAL . 45.5 t-105 -60.6 -48.52 81.39 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 118.373 0.533 . . . . 73.23 110.567 176.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.42 -37.08 84.41 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 118.931 -0.557 . . . . 75.45 110.961 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.5 mm-40 -61.42 -48.23 82.15 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.265 0.484 . . . . 52.22 111.398 175.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.0 tt -64.79 -51.93 59.55 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.294 1.438 . . . . 65.43 109.733 -175.528 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.9 t -60.78 -42.24 97.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.802 1.241 . . . . 71.23 111.538 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.2 -55.88 27.1 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 119.342 -0.361 . . . . 65.44 110.86 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 4.5 pp -61.53 -29.82 70.24 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.579 0.228 . . . . 71.1 111.571 -177.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.558 HD22 ' SD ' ' A' ' 122' ' ' MET . 58.9 mt -62.42 -53.63 52.01 Favored 'General case' 0 C--N 1.359 0.99 0 CA-C-N 115.813 -0.63 . . . . 71.53 111.126 171.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -68.88 -35.1 76.48 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.979 0.512 . . . . 73.41 111.839 -175.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.61 -58.68 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.183 0.593 . . . . 63.43 110.512 -177.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -97.05 -56.42 2.56 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.354 0.502 . . . . 64.34 112.354 -171.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -71.46 -14.87 62.27 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 112.128 0.418 . . . . 71.35 112.128 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 60.53 23.53 13.22 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.842 1.257 . . . . 74.51 111.975 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.558 ' SD ' HD22 ' A' ' 116' ' ' LEU . 64.4 mtp -79.96 118.26 71.52 Favored Pre-proline 0 C--N 1.351 0.666 0 C-N-CA 124.408 1.083 . . . . 75.1 109.552 179.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -84.7 48.68 2.45 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 123.148 2.565 . . . . 62.34 111.882 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.54 HG12 ' HH2' ' A' ' 109' ' ' TRP . 51.5 t -91.32 80.33 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.346 0.429 0 C-N-CA 124.213 1.005 . . . . 74.23 109.514 -174.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 21.2 t -166.06 84.6 0.97 Allowed Pre-proline 0 C--O 1.242 0.709 0 CA-C-N 114.735 -1.12 . . . . 70.44 108.383 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -79.03 35.8 0.58 Allowed 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 123.103 2.535 . . . . 63.0 112.214 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 8.4 tt -157.54 -52.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 123.973 0.909 . . . . 73.54 110.472 -172.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.9 t 57.99 -148.79 0.47 Allowed 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.014 0.926 . . . . 75.54 109.536 -172.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.53 -89.28 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.968 0.907 . . . . 72.52 110.672 170.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 75.93 -26.3 1.45 Allowed Glycine 0 CA--C 1.545 1.916 0 N-CA-C 116.169 1.228 . . . . 42.11 116.169 170.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -81.59 -58.02 3.2 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.318 1.059 . . . . 50.11 111.62 -172.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 61.0 m -75.18 -12.68 60.35 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.425 0.69 . . . . 60.14 110.924 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 11.0 t90 -51.01 -54.77 21.61 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.955 1.302 . . . . 65.22 110.888 177.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.23 -20.63 65.71 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.793 0.837 . . . . 73.44 112.145 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 138' ' ' GLN . 67.3 mt-30 -77.68 -34.23 53.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.32 0.648 . . . . 70.44 110.27 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . 45.2 mt-10 -64.88 -42.19 95.01 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 109.236 -0.653 . . . . 73.44 109.236 173.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -56.52 -44.72 81.07 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.886 0.741 . . . . 74.14 111.836 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 12.6 pt20 -76.17 -30.7 58.19 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.387 0.429 . . . . 64.43 111.58 -176.401 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -65.63 -53.05 46.88 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.654 0.782 . . . . 74.13 110.253 174.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.8 -46.88 77.91 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 114.534 -1.212 . . . . 71.35 111.221 175.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.2 -29.26 68.07 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.821 0.849 . . . . 22.54 112.808 -177.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.36 -49.62 66.29 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.157 0.503 . . . . 64.21 109.988 175.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.7 -31.69 73.03 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.382 -1.281 . . . . 72.04 111.605 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.7 t0 -79.55 -41.44 27.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.058 0.943 . . . . 71.33 111.509 -175.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 53.8 ttt180 -66.6 -37.16 84.32 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.731 . . . . 64.24 109.629 176.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -68.7 -35.64 77.45 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.317 -0.856 . . . . 70.35 110.829 171.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -23.96 61.31 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.664 0.386 . . . . 63.14 111.172 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.3 OUTLIER -79.7 -60.82 2.2 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.31 0.644 . . . . 63.4 110.011 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 149' ' ' GLN . . . . . 0.505 HE22 HD23 ' A' ' 89' ' ' LEU . 2.0 mp0 -71.03 -45.35 64.06 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.841 0.456 . . . . 73.21 111.186 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ttm -99.88 60.38 1.09 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.016 -1.105 . . . . 44.2 108.016 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 30.9 tp -81.74 89.68 6.3 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.17 0.986 . . . . 72.22 109.311 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.84 25.97 5.58 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 113.564 -1.653 . . . . 62.13 108.767 176.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.59 ' HG2' ' H ' ' A' ' 154' ' ' ASP . 56.2 ttt180 -119.36 -163.65 1.0 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 107.211 -1.403 . . . . 74.32 107.211 -177.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.59 ' H ' ' HG2' ' A' ' 153' ' ' ARG . 45.2 m-20 -54.9 105.82 0.18 Allowed 'General case' 0 C--N 1.356 0.869 0 CA-C-N 118.536 0.607 . . . . 61.14 109.931 166.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -77.5 -15.47 59.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.694 -0.685 . . . . 71.0 110.448 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--O 1.253 1.273 0 CA-C-O 118.714 -0.66 . . . . 75.32 110.419 178.111 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.529 ' SD ' ' HA ' ' A' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.376 0.131 . . . . 64.31 111.169 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -62.89 -28.9 70.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.898 0.879 . . . . 71.52 111.669 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.21 -45.22 61.82 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.465 0.706 . . . . 73.13 110.314 172.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.0 mm? -65.06 -41.56 95.01 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 115.153 -0.93 . . . . 70.34 110.675 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -57.82 -46.55 84.54 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 109.605 -0.517 . . . . 65.41 109.605 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -60.79 -55.46 32.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.757 0.66 . . . . 71.12 110.859 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.7 mt -57.42 -53.95 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.724 0.809 . . . . 73.42 112.167 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.509 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -61.07 -44.34 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.301 1.04 . . . . 72.31 110.511 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 95.9 m -63.73 -46.38 85.64 Favored 'General case' 0 C--N 1.358 0.952 0 C-N-CA 122.88 0.472 . . . . 72.14 111.262 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.8 -46.28 87.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.466 0.706 . . . . 60.24 110.936 -178.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.419 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.2 -49.93 71.1 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 124.608 1.193 . . . . 64.55 111.966 178.043 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.4 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 70.8 mt-30 -56.09 -46.72 78.95 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.962 0.505 . . . . 70.3 111.365 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.2 -38.32 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.789 0.836 . . . . 73.3 111.15 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.25 -53.59 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.771 0.828 . . . . 62.24 110.197 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -60.73 -33.05 72.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.848 0.859 . . . . 74.54 111.43 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.7 mptm? -75.22 -53.17 9.25 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.293 0.637 . . . . 72.31 111.186 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.477 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 12.1 ptm180 -66.93 -30.44 70.58 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 111.753 0.279 . . . . 73.21 111.753 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.1 t -59.76 -17.89 38.93 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.861 1.264 . . . . 61.02 112.995 -175.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -53.32 -23.57 9.59 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.602 0.761 . . . . 60.34 112.332 173.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.72 -13.28 61.97 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.197 0.999 . . . . 71.54 112.066 -178.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.1 mmt -76.3 96.35 3.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.514 -0.551 . . . . 75.34 109.514 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -29.42 39.35 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.456 -0.942 . . . . 75.2 108.456 174.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.407 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 43.6 m-85 -99.97 175.99 5.58 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.439 1.096 . . . . 75.11 110.194 169.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' HG21 ' A' ' 85' ' ' ILE . 70.9 m 53.67 79.5 0.13 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.385 1.053 . . . . 64.11 110.138 -171.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -73.86 -61.21 1.93 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.551 -0.749 . . . . 75.25 109.591 -170.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 48.8 mttm -67.15 -39.52 86.55 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 114.416 -1.266 . . . . 74.3 111.781 -174.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.462 ' HG2' HH22 ' A' ' 30' ' ' ARG . 45.7 mt-30 -71.22 -31.45 67.6 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.07 0.548 . . . . 53.13 111.84 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 53.2 t -76.63 -40.79 48.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.315 0.646 . . . . 53.42 110.692 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 mtp-105 -65.39 -38.35 89.72 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.219 0.608 . . . . 74.24 110.657 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.629 HH22 ' HB2' ' A' ' 141' ' ' ALA . 6.5 mtp180 -66.44 -44.42 82.92 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.175 -0.917 . . . . 72.2 109.939 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 ' SG ' ' A' ' 18' ' ' CYS . 55.5 tp -56.08 -49.29 74.22 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.71 0.631 . . . . 72.33 110.776 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.36 -45.87 92.42 Favored Glycine 0 C--N 1.351 1.388 0 O-C-N 123.989 0.806 . . . . 53.5 112.166 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -60.93 -42.55 98.4 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.309 1.043 . . . . 74.52 111.49 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 57.1 mtt180 -59.22 -61.04 2.93 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.7 -0.852 . . . . 75.4 108.7 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.3 t -51.09 -49.04 29.74 Favored 'Isoleucine or valine' 0 C--N 1.353 0.75 0 O-C-N 125.47 1.731 . . . . 55.03 111.636 -175.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 97.1 mt -61.12 -43.61 98.62 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 124.097 0.873 . . . . 62.03 111.063 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.88 -25.59 74.18 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.553 0.533 . . . . 51.13 113.354 176.536 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.518 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 20.0 mt -82.89 -43.12 16.93 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.204 0.602 . . . . 62.12 111.127 -177.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.419 HG21 ' HA3' ' A' ' 11' ' ' GLY . 12.1 pt -79.07 -30.98 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.43 -0.795 . . . . 73.21 110.544 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 57.2 tptt -43.07 -59.45 3.11 Favored Pre-proline 0 N--CA 1.494 1.772 0 C-N-CA 124.346 1.058 . . . . 74.4 113.127 -178.178 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 26.0 Cg_exo -65.8 -31.62 47.98 Favored 'Trans proline' 0 C--N 1.392 2.835 0 C-N-CA 122.133 1.888 . . . . 74.42 112.609 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.4 mm? -79.44 -25.06 42.06 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.415 0.686 . . . . 74.12 110.768 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -73.01 -36.3 66.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.345 0.658 . . . . 74.14 109.324 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.7 mmt -63.79 -24.55 67.8 Favored 'General case' 0 N--CA 1.482 1.139 0 O-C-N 123.74 0.65 . . . . 64.33 110.529 175.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 77.2 mt -73.83 -64.01 1.09 Allowed 'General case' 0 C--N 1.355 0.814 0 N-CA-C 109.276 -0.639 . . . . 73.42 109.276 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -54.71 -34.65 62.71 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.182 0.808 . . . . 73.1 113.182 -167.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -73.39 -67.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.403 0.281 . . . . 74.44 111.7 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.36 -59.11 2.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 120.69 0.281 . . . . 73.22 111.023 -174.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.34 63.69 4.12 Favored Glycine 0 C--N 1.344 0.977 0 CA-C-N 115.842 -0.617 . . . . 74.13 111.832 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.529 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 5.0 ttmp? -88.05 152.92 21.68 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 108.927 -0.768 . . . . 74.1 108.927 176.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 68.62 20.28 8.34 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 124.641 1.176 . . . . 63.33 111.444 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.451 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 46.7 m -66.04 144.65 56.59 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.328 -0.619 . . . . 62.24 109.328 171.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 41.5 t -98.08 102.04 12.73 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.566 0.747 . . . . 71.13 109.082 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 52' ' ' SER . 8.2 Cg_exo -73.71 130.02 14.23 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.568 2.179 . . . . 72.12 109.993 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 69.8 p -63.85 171.28 2.86 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.24 0.616 . . . . 52.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -58.85 -45.17 90.71 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.978 0.511 . . . . 70.32 111.126 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -70.79 -34.68 72.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.279 0.631 . . . . 65.41 111.867 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.562 HD22 HD13 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -59.82 -49.26 78.42 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.182 -1.044 . . . . 73.14 108.182 176.681 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -64.98 -35.18 80.36 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.482 1.113 . . . . 61.45 111.014 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.2 m -59.33 -48.26 82.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.845 0.458 . . . . 73.34 110.54 176.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.98 -40.6 94.07 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.833 0.708 . . . . 73.21 110.98 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.97 -41.36 97.91 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.542 0.737 . . . . 73.21 111.836 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -69.78 -39.1 76.83 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.444 0.698 . . . . 65.42 110.719 -178.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -65.76 -37.96 87.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.408 0.683 . . . . 75.22 110.884 176.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 1.7 t80 -70.05 -43.49 71.14 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.882 0.739 . . . . 73.22 109.969 -177.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -58.99 -50.26 74.76 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.669 1.188 . . . . 65.5 110.825 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.91 -41.42 97.9 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 124.019 0.824 . . . . 72.14 111.241 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.433 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -63.88 -38.88 92.73 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.88 0.737 . . . . 42.11 111.169 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.68 -43.71 92.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.084 0.554 . . . . 73.52 110.886 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.72 -34.02 76.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.451 0.701 . . . . 62.54 111.095 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 36.9 mm-40 -69.3 -42.93 74.78 Favored 'General case' 0 C--N 1.351 0.634 0 O-C-N 123.603 0.564 . . . . 72.14 111.349 175.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.48 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.066 0.546 . . . . 44.43 111.173 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -60.36 -44.54 95.49 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.17 0.988 . . . . 61.32 109.641 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -62.11 -36.73 93.37 Favored Glycine 0 C--N 1.347 1.183 0 O-C-N 124.239 0.962 . . . . 74.0 112.916 176.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 18.2 mm-40 -62.75 -56.93 13.13 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 117.273 0.536 . . . . 63.41 110.16 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.9 pt -65.56 -18.98 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 112.169 0.433 . . . . 54.31 112.169 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.477 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 27.2 tt0 -70.91 -39.91 72.45 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 122.691 0.396 . . . . 74.54 110.653 173.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 48.9 mttm -74.98 -30.23 61.12 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.899 0.381 . . . . 72.54 110.467 175.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.0 m-85 -81.36 0.03 39.12 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.662 0.785 . . . . 64.35 112.228 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.6 p -55.75 -34.79 65.52 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.82 0.819 . . . . 61.34 110.955 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.484 ' HB2' ' ND2' ' A' ' 84' ' ' ASN . 21.6 m-80 -93.67 113.5 25.6 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.164 -1.421 . . . . 54.42 107.164 168.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -69.76 -21.53 63.43 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.941 0.896 . . . . 74.52 110.843 -171.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.3 m -63.13 -33.46 75.5 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.917 0.887 . . . . 72.21 111.691 173.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 81' ' ' ASN . 88.3 m-20 -67.09 -38.3 85.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.264 0.626 . . . . 72.31 110.228 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 97' ' ' LEU . 52.2 mt -55.72 -60.86 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.967 0 O-C-N 124.082 0.864 . . . . 74.23 109.197 172.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 52.7 t -53.82 -37.78 63.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.08 0.952 . . . . 35.34 111.63 -177.778 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -58.78 -57.54 12.58 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.429 1.08 . . . . 44.55 111.033 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.51 -28.2 56.31 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 110.366 -0.235 . . . . 75.34 110.366 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.7 tp -68.43 -39.7 81.43 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.454 1.102 . . . . 74.5 110.934 -171.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.9 t -65.26 -31.25 72.31 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.626 0.579 . . . . 73.31 110.956 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.23 -1.26 31.58 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.833 0.853 . . . . 70.34 111.64 -177.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 t -70.38 131.08 43.57 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.493 0.717 . . . . 70.43 111.139 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.25 -9.99 26.62 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.425 0.69 . . . . 65.14 109.764 168.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -71.44 -52.63 17.47 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.563 0.745 . . . . 63.4 109.611 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.586 ' HD2' ' HA ' ' A' ' 142' ' ' ASP . 37.4 ttpt 80.31 -39.81 0.18 Allowed 'General case' 0 C--N 1.363 1.186 0 O-C-N 125.73 1.893 . . . . 63.44 111.684 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.605 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 4.2 mp -73.42 132.93 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 107.696 -1.224 . . . . 62.25 107.696 165.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.675 HD11 HG23 ' A' ' 85' ' ' ILE . 10.9 tp -62.97 -29.6 70.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.062 0.945 . . . . 74.14 112.734 -172.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.441 ' H ' HG22 ' A' ' 96' ' ' ILE . 52.2 m-85 -120.33 8.63 10.85 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 117.999 -1.001 . . . . 71.45 111.211 -174.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.605 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 28.2 ttpt -35.68 -59.59 0.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 114.724 1.379 . . . . 44.34 114.724 -156.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 31.3 t70 -66.89 -42.98 84.61 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.63 0.772 . . . . 60.03 111.563 -175.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.59 -38.02 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.242 0.617 . . . . 65.32 110.179 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -80.27 -18.16 50.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.42 0.688 . . . . 61.42 110.233 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -73.68 -34.0 64.69 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.505 -0.924 . . . . 75.02 108.505 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 48.3 mttm -62.9 -46.47 87.68 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.482 -0.562 . . . . 72.14 109.482 170.01 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.433 HD22 ' HB1' ' A' ' 68' ' ' ALA . 3.8 mm? -56.23 -43.29 78.47 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 123.336 0.397 . . . . 63.25 110.902 173.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t -70.46 -34.95 73.01 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.332 0.653 . . . . 50.41 111.332 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 18.0 t70 -72.27 -55.53 7.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.982 0.913 . . . . 72.41 109.496 -176.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.87 -53.76 38.33 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 114.907 -1.042 . . . . 74.43 109.598 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -61.5 -37.97 85.61 Favored 'General case' 0 C--N 1.357 0.93 0 CA-C-O 118.364 -0.827 . . . . 75.2 112.831 -175.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.7 ptmt -65.39 -47.64 75.65 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.556 1.071 . . . . 73.2 108.921 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.03 -35.59 80.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 120.93 0.395 . . . . 60.1 110.899 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 7.3 tt -72.82 -44.42 61.5 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.803 1.241 . . . . 62.14 110.023 -173.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 31.1 t -67.4 -40.93 85.66 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.349 0.66 . . . . 74.12 109.444 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 92.5 mt -64.13 -39.74 94.68 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 123.504 0.502 . . . . 73.43 112.019 178.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.562 HD13 HD22 ' A' ' 58' ' ' LEU . 4.2 pp -73.88 -25.25 59.93 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.064 0.393 . . . . 71.13 110.515 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.571 HD13 ' SD ' ' A' ' 122' ' ' MET . 89.8 mt -69.67 -32.01 70.4 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 119.61 -0.233 . . . . 72.12 110.393 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 113' ' ' SER . 24.0 mm-40 -67.21 -52.35 42.22 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.803 0.441 . . . . 65.41 110.063 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -76.26 -60.31 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.326 -0.852 . . . . 63.3 111.384 -172.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.44 -56.23 7.12 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.763 0.425 . . . . 61.14 111.239 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -95.97 -11.55 26.37 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.267 0.84 . . . . 64.01 113.267 -168.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 55.28 71.41 0.54 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.809 0.844 . . . . 74.14 111.393 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.571 ' SD ' HD13 ' A' ' 116' ' ' LEU . 55.7 ttm -104.84 123.5 39.82 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 122.997 0.519 . . . . 71.32 110.115 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -82.39 76.3 4.24 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.499 2.133 . . . . 75.05 112.396 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 31.9 m -73.54 136.43 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 109.302 -0.629 . . . . 72.01 109.302 172.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.44 ' H ' ' HD2' ' A' ' 126' ' ' PRO . 33.1 t -141.6 -46.28 0.02 OUTLIER Pre-proline 0 CA--C 1.556 1.191 0 CA-C-O 118.005 -0.998 . . . . 72.15 112.361 -173.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.44 ' HD2' ' H ' ' A' ' 125' ' ' SER . 87.7 Cg_exo -52.26 -45.74 37.38 Favored 'Trans proline' 0 C--N 1.397 3.094 0 C-N-CA 122.054 1.836 . . . . 64.14 112.615 171.001 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 11.4 tt -144.15 143.93 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 N-CA-C 108.681 -0.859 . . . . 75.41 108.681 176.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.6 m -145.26 -59.57 0.34 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.99 0.516 . . . . 72.42 110.67 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.425 ' OE1' ' HB3' ' A' ' 131' ' ' ALA . 0.3 OUTLIER -77.11 -49.55 15.02 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.192 0.997 . . . . 75.53 109.386 -173.486 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 86.84 -28.2 5.57 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 114.94 0.736 . . . . 53.23 114.94 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.425 ' HB3' ' OE1' ' A' ' 129' ' ' GLN . . . -72.93 -14.7 61.51 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 117.551 0.675 . . . . 44.23 112.706 -174.772 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.7 t -61.53 -21.67 64.46 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 122.989 0.516 . . . . 64.23 111.421 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -54.61 -43.23 72.05 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.614 0.765 . . . . 72.51 111.057 172.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.77 -19.93 60.29 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 112.51 0.559 . . . . 55.22 112.51 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -91.41 -60.68 1.83 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.868 0.867 . . . . 64.24 110.783 170.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.48 -62.68 1.52 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.785 1.234 . . . . 74.41 111.55 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.69 66.82 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.344 -1.298 . . . . 75.32 111.527 -176.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.435 ' HA ' HD11 ' A' ' 96' ' ' ILE . 36.2 tt0 -72.34 -56.21 5.86 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.65 0.594 . . . . 72.12 111.601 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.422 ' O ' ' HB3' ' A' ' 142' ' ' ASP . 13.5 mm100 -69.22 -28.03 66.0 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.729 0.643 . . . . 74.54 111.407 -176.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -86.74 -28.46 23.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.952 -0.567 . . . . 43.54 110.593 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.629 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -72.34 -26.56 61.97 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 109.825 -0.435 . . . . 73.45 109.825 168.102 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.586 ' HA ' ' HD2' ' A' ' 95' ' ' LYS . 25.5 t70 -62.58 -52.66 62.53 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 123.933 0.77 . . . . 53.35 108.941 172.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -60.87 -37.27 81.56 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.603 1.19 . . . . 74.14 113.138 174.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.9 t0 -76.94 -46.28 24.74 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.022 0.378 . . . . 72.21 112.022 -174.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.467 ' HD3' ' HG3' ' A' ' 95' ' ' LYS . 78.5 ttt180 -63.41 -36.54 84.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.492 0.717 . . . . 64.42 110.487 173.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -57.33 -47.21 82.17 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 115.565 -0.743 . . . . 72.42 109.507 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.35 -32.8 74.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.168 0.917 . . . . 75.22 111.889 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 1.1 t80 -65.24 -43.14 92.36 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.237 0.615 . . . . 73.51 109.854 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -85.07 -20.34 30.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.136 0.574 . . . . 71.44 111.645 179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -79.67 -62.69 1.61 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.03 0.532 . . . . 62.5 109.933 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 92.9 mt 46.26 109.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 126.277 1.831 . . . . 72.14 113.619 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -106.21 77.75 1.25 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.516 -0.92 . . . . 71.41 108.516 -176.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -161.25 -87.12 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.15 -0.932 . . . . 72.42 109.367 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -148.76 115.55 6.0 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 107.731 -1.211 . . . . 54.24 107.731 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -108.82 128.99 55.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.441 0.696 . . . . 64.04 110.598 -173.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 CA--C 1.549 0.914 0 C-N-CA 123.822 0.849 . . . . 74.21 109.117 -179.177 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.414 ' SD ' ' O ' ' A' ' 1' ' ' MET . 11.8 tmm? . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 119.438 -0.315 . . . . 54.24 110.914 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -59.7 -35.25 74.13 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 118.167 0.44 . . . . 61.23 111.93 -172.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.96 -32.52 72.96 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.949 0.499 . . . . 72.22 111.338 177.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.479 ' O ' ' HB ' ' A' ' 7' ' ' ILE . 5.9 tt -68.3 -39.64 81.99 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.391 0.676 . . . . 52.14 109.363 174.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -68.13 -29.85 68.85 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.199 0.2 . . . . 45.52 110.802 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -70.59 -34.74 72.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 119.159 -0.448 . . . . 72.01 110.416 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.479 ' HB ' ' O ' ' A' ' 4' ' ' LEU . 61.2 mt -56.26 -47.88 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.679 0.792 . . . . 61.44 110.085 169.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.2 mm -59.36 -46.93 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 115.249 -0.887 . . . . 65.23 111.16 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 13' ' ' VAL . 87.2 m -60.8 -47.46 86.23 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.876 0.871 . . . . 62.31 110.757 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -57.81 -50.62 72.67 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 123.948 0.78 . . . . 72.43 110.76 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.06 -35.05 91.5 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.602 1.189 . . . . 43.35 113.487 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -72.39 -39.71 67.79 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 122.686 0.395 . . . . 65.4 110.194 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 9' ' ' THR . 98.6 t -72.96 -26.73 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.275 0.63 . . . . 44.41 110.257 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.583 HG21 HG21 ' A' ' 35' ' ' VAL . 26.4 mt -60.13 -53.49 47.94 Favored 'Isoleucine or valine' 0 C--N 1.361 1.068 0 N-CA-C 108.897 -0.779 . . . . 70.22 108.897 171.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -57.23 -41.09 78.86 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.321 1.013 . . . . 74.12 110.94 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -53.84 -59.64 4.36 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 124.169 0.918 . . . . 74.0 112.103 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -84.13 -16.56 43.16 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 113.703 1.001 . . . . 74.22 113.703 -172.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.51 -20.55 65.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.952 0.901 . . . . 74.11 111.952 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -58.46 -19.48 37.11 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 113.269 0.84 . . . . 65.5 113.269 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -67.19 -20.2 65.68 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.804 0.668 . . . . 70.02 112.804 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.3 mmt -79.12 85.4 5.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.251 0.548 . . . . 73.11 110.752 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -75.21 -33.87 61.43 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.609 -1.256 . . . . 55.31 107.609 166.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 46.4 m-85 -92.33 162.87 14.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 114.619 -1.173 . . . . 71.23 110.37 173.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.9 m 54.32 65.55 1.48 Allowed 'General case' 0 C--N 1.354 0.766 0 O-C-N 124.636 1.21 . . . . 44.31 109.637 -170.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 26' ' ' LYS . 49.4 pttt -53.22 -50.07 65.48 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 114.771 -1.104 . . . . 72.22 110.524 -174.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 25' ' ' LYS . 5.5 mtpm? -80.77 -25.43 37.95 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-O 118.349 -0.834 . . . . 53.52 111.322 -172.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.833 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 18.1 mm-40 -70.56 -36.33 73.57 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 119.196 0.907 . . . . 74.41 109.775 175.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.0 t -67.08 -45.81 76.17 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 44.52 110.359 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.84 -33.4 66.13 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.327 -0.851 . . . . 72.53 111.238 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.677 HH22 ' HB2' ' A' ' 141' ' ' ALA . 16.6 ttm180 -69.99 -45.81 66.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.462 -0.57 . . . . 72.23 109.462 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.438 HD21 HD13 ' A' ' 76' ' ' ILE . 41.8 tp -62.89 -46.14 89.26 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 124.114 0.884 . . . . 74.14 109.696 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.52 -47.3 91.4 Favored Glycine 0 C--N 1.346 1.086 0 O-C-N 123.723 0.639 . . . . 72.22 112.614 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -60.67 -49.74 76.32 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.71 0.804 . . . . 63.43 111.12 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.534 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 17.1 mtt180 -61.66 -64.12 1.04 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.754 -1.112 . . . . 70.41 109.955 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.583 HG21 HG21 ' A' ' 14' ' ' ILE . 61.2 t -56.07 -46.73 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 124.14 0.9 . . . . 74.53 111.929 -171.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.232 0.332 . . . . 73.44 110.502 176.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.0 -20.0 74.26 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 114.307 0.483 . . . . 71.21 114.307 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 49.5 mt -87.23 -46.82 9.38 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.504 0.722 . . . . 71.05 110.792 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 12.4 pt -77.75 -38.9 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-O 118.925 -0.56 . . . . 74.11 111.482 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -56.48 -46.06 99.86 Favored Pre-proline 0 N--CA 1.487 1.386 0 N-CA-C 113.795 1.035 . . . . 72.52 113.795 -171.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -54.44 -51.67 9.98 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 121.581 1.521 . . . . 74.11 111.276 172.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.77 -31.28 72.22 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 115.452 -0.794 . . . . 72.11 111.662 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -66.44 -60.5 2.68 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.748 0.819 . . . . 75.51 110.576 178.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.2 ptp -61.11 -36.33 79.43 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 124.111 0.882 . . . . 71.43 111.455 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.606 HD13 ' SD ' ' A' ' 122' ' ' MET . 82.9 mt -67.42 -47.59 69.78 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.504 0.721 . . . . 74.42 110.305 177.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -61.57 -35.07 76.75 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.811 0.694 . . . . 74.43 111.727 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -64.5 -37.9 89.16 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.085 0.554 . . . . 61.32 111.437 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.18 -46.91 13.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.574 0.75 . . . . 73.12 110.522 -177.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -166.37 146.94 11.43 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.337 -0.392 . . . . 52.2 112.783 -175.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.53 161.75 17.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.682 0.793 . . . . 62.0 109.392 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -113.54 98.06 6.83 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.167 0.587 . . . . 72.35 109.697 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.0 m -80.03 150.2 30.45 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.05 0.54 . . . . 71.34 110.141 174.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 39.1 t 60.58 73.01 0.66 Allowed Pre-proline 0 CA--C 1.557 1.218 0 C-N-CA 125.003 1.321 . . . . 62.22 110.068 -170.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -83.5 174.58 8.76 Favored 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.741 2.294 . . . . 71.12 111.781 174.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 81.1 p -86.59 178.5 7.04 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.89 0.376 . . . . 42.33 110.952 178.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.56 -33.95 76.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.127 -0.942 . . . . 73.13 110.228 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.612 ' HB3' HD22 ' A' ' 115' ' ' LEU . 35.7 mtmm -58.1 -55.18 38.26 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.589 0.756 . . . . 71.11 110.573 174.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.563 HD22 HD13 ' A' ' 115' ' ' LEU . 4.4 mm? -59.82 -49.38 77.92 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.646 0.778 . . . . 74.33 111.537 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.8 m -58.41 -50.42 73.74 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 123.931 0.769 . . . . 73.3 111.206 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.6 m -68.82 -36.51 78.31 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.319 0.648 . . . . 62.52 111.53 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -68.79 -44.24 74.0 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.645 -0.502 . . . . 63.34 109.645 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -40.33 96.66 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.987 -1.006 . . . . 64.23 111.44 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -66.83 -42.49 85.72 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.202 0.601 . . . . 73.11 111.538 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -69.15 -42.15 76.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.62 0.768 . . . . 73.25 111.027 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.413 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 20.1 t80 -71.03 -37.79 72.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.132 0.973 . . . . 73.44 110.102 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.5 ttpp -61.75 -51.19 69.37 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.289 -0.868 . . . . 73.01 109.077 174.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.66 -41.31 73.45 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.17 0.919 . . . . 75.15 111.713 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.597 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -62.27 -43.41 98.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.967 -1.015 . . . . 63.23 111.746 177.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.8 mt -75.79 -25.96 56.86 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.171 0.588 . . . . 61.24 112.214 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 52.8 mt-10 -65.74 -45.77 81.36 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.215 0.606 . . . . 74.11 109.404 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.17 -39.25 78.85 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.637 -1.165 . . . . 74.22 111.011 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.462 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -64.08 -43.37 95.62 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.5 0.5 . . . . 52.24 110.736 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -61.59 -46.73 88.62 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 124.547 1.154 . . . . 62.12 109.734 179.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -61.22 -42.11 99.69 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.081 -0.963 . . . . 73.34 112.446 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -59.41 -53.15 61.44 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 118.931 -0.557 . . . . 65.42 111.667 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -65.71 -28.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 N-CA-C 112.446 0.536 . . . . 71.03 112.446 178.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -64.64 -33.13 75.22 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.444 0.298 . . . . 61.32 110.687 172.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 42.2 mttm -85.5 -28.09 25.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.021 0.529 . . . . 71.45 111.012 176.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.472 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.3 m-85 -76.67 -2.84 34.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.935 0.894 . . . . 61.14 112.135 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -57.69 -25.32 60.11 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.346 0.659 . . . . 73.0 110.378 170.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -84.46 107.29 16.63 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 107.712 -1.218 . . . . 61.54 107.712 164.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -72.91 -23.65 60.73 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.469 0.708 . . . . 63.12 110.736 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.2 p -68.73 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.128 0.971 . . . . 73.21 111.335 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -61.4 -41.6 97.4 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.79 0.836 . . . . 74.21 110.236 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 97' ' ' LEU . 39.3 mt -56.89 -60.15 2.31 Favored 'Isoleucine or valine' 0 C--N 1.354 0.794 0 CA-C-N 115.109 -0.95 . . . . 74.54 109.479 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.2 t -58.27 -34.51 70.58 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 123.964 0.79 . . . . 53.0 111.631 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -59.63 -56.45 21.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.977 1.311 . . . . 73.25 110.885 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.91 -22.23 42.99 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.853 -0.158 . . . . 75.24 110.583 -177.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.2 tp -76.27 -33.96 59.12 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.58 0.752 . . . . 64.34 111.081 -172.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.3 t -68.95 -25.05 64.36 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 110.065 -0.346 . . . . 61.3 110.065 173.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.82 17.62 22.29 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.433 1.093 . . . . 61.12 111.326 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 91.3 p -67.69 113.24 5.31 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 109.276 -0.638 . . . . 65.31 109.276 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -70.88 -13.01 61.87 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.263 -0.88 . . . . 61.05 111.167 -176.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -118.44 -100.13 0.44 Allowed 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.419 -1.326 . . . . 63.23 107.419 167.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.468 ' HG3' HD12 ' A' ' 96' ' ' ILE . 14.9 pttm 175.54 -25.82 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.332 1.453 . . . . 72.53 110.335 -176.676 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.468 HD12 ' HG3' ' A' ' 95' ' ' LYS . 3.6 mp -72.17 131.18 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 108.985 -0.746 . . . . 71.25 108.985 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.833 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.0 tp -60.6 -40.67 92.65 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.694 0.759 . . . . 44.15 111.968 -171.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.421 ' HB3' ' HB ' ' A' ' 101' ' ' VAL . 5.0 m-85 -112.02 38.03 2.8 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.992 -1.004 . . . . 73.42 108.528 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -39.49 -53.53 2.05 Favored 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 113.568 0.951 . . . . 74.12 113.568 -160.085 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 34.6 t70 -80.07 -40.7 27.09 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.372 0.669 . . . . 73.42 110.74 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.421 ' HB ' ' HB3' ' A' ' 98' ' ' PHE . 56.3 t -62.91 -54.43 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.644 0.777 . . . . 62.35 111.371 -177.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -69.45 -26.06 64.4 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.034 0.934 . . . . 70.33 111.213 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -35.75 77.14 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.105 0.412 . . . . 73.42 110.993 164.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.9 mttm -66.01 -44.79 83.72 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.221 -0.659 . . . . 74.41 109.221 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.8 mp -53.47 -44.89 69.31 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.354 0.409 . . . . 71.23 109.972 174.001 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.42 ' HA ' ' CZ3' ' A' ' 133' ' ' TRP . 21.1 m -62.88 -57.64 10.12 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.776 0.673 . . . . 75.31 112.108 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.1 t70 -72.43 -41.71 65.87 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 114.865 -1.061 . . . . 51.14 110.692 -169.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 51.4 t -74.2 -28.79 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 115.862 -0.608 . . . . 61.12 110.882 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.409 ' CD2' HD22 ' A' ' 38' ' ' LEU . 62.5 t-105 -67.83 -37.91 82.54 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.37 0.532 . . . . 72.43 110.439 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.7 mtpt -55.12 -52.73 62.33 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.523 -0.547 . . . . 75.11 109.523 173.357 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.49 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 39.7 mt-10 -53.74 -51.73 62.39 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 124.424 1.078 . . . . 71.31 111.028 174.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -66.06 -55.24 17.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.054 0.942 . . . . 73.02 109.651 -168.464 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.2 p -59.63 -40.34 87.32 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.394 0.678 . . . . 74.41 112.0 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.7 pp -64.08 -43.01 96.71 Favored 'General case' 0 C--N 1.37 1.457 0 CA-C-N 118.139 0.427 . . . . 71.53 110.839 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.612 HD22 ' HB3' ' A' ' 57' ' ' LYS . 4.2 pp -74.6 -20.99 59.71 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.476 0.547 . . . . 53.11 112.476 177.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 43.0 mt -69.42 -36.78 77.03 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 110.041 -0.355 . . . . 75.02 110.041 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.434 HE21 ' HB2' ' A' ' 125' ' ' SER . 22.4 mm-40 -78.02 -38.34 44.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.321 0.648 . . . . 74.24 111.419 178.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 49.9 t -74.57 -62.63 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.339 0.656 . . . . 63.11 111.138 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -89.8 -57.11 2.98 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 122.383 -0.198 . . . . 64.01 111.382 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -67.12 -23.19 65.79 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.638 0.586 . . . . 62.21 111.899 -172.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 56.89 32.22 21.07 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.332 1.053 . . . . 72.03 111.848 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.606 ' SD ' HD13 ' A' ' 45' ' ' LEU . 41.4 mtm -91.29 146.17 32.91 Favored Pre-proline 0 N--CA 1.467 0.422 0 N-CA-C 108.818 -0.808 . . . . 72.45 108.818 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -84.78 39.59 0.76 Allowed 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 123.06 2.507 . . . . 71.11 112.287 -173.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.9 t -81.11 90.48 1.83 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 123.846 0.858 . . . . 73.44 109.98 -175.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.434 ' HB2' HE21 ' A' ' 117' ' ' GLN . 41.6 t -143.35 73.68 17.57 Favored Pre-proline 0 CA--C 1.546 0.804 0 CA-C-N 114.603 -1.18 . . . . 62.43 108.816 174.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -89.42 23.37 0.73 Allowed 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 123.342 2.695 . . . . 73.1 111.776 174.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.5 tt -156.29 144.52 11.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 124.276 1.03 . . . . 71.52 108.933 -172.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 26.3 m -82.39 85.04 6.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.475 0.71 . . . . 63.33 109.702 176.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 72.44 -69.27 0.19 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 125.567 1.547 . . . . 72.34 111.321 175.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.79 5.82 7.44 Favored Glycine 0 N--CA 1.471 1.02 0 CA-C-O 119.481 -0.622 . . . . 45.23 114.221 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 117.38 0.59 . . . . 75.34 110.489 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 21.9 m -68.83 -20.35 64.3 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 115.171 -0.922 . . . . 63.4 112.662 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.42 ' CZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER -60.17 -31.38 70.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.632 0.773 . . . . 74.05 111.558 -179.629 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -32.33 73.82 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.697 0.399 . . . . 74.43 111.424 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 46.7 mt-30 -84.12 -37.87 21.43 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.775 0.83 . . . . 75.34 110.838 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.85 -52.65 64.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.42 1.088 . . . . 74.43 110.73 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.69 -37.28 86.02 Favored 'General case' 0 C--O 1.239 0.506 0 O-C-N 124.665 1.228 . . . . 65.33 112.907 -174.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 1.5 pp0? -68.73 -48.68 63.18 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 109.922 -0.399 . . . . 75.24 109.922 177.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -63.37 -37.9 89.08 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.298 0.571 . . . . 74.13 111.441 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.13 -49.54 76.82 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.408 1.083 . . . . 55.51 109.722 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.677 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.51 -21.14 59.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.074 -0.966 . . . . 72.12 112.052 -178.703 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -64.81 -54.41 31.62 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.89 -0.781 . . . . 74.3 108.89 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.27 -39.35 92.49 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.269 0.981 . . . . 71.12 110.502 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.467 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 39.5 t0 -74.37 -48.52 27.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.661 -0.699 . . . . 70.54 112.163 -174.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 36.6 ttt-85 -65.65 -34.37 78.06 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.527 -0.546 . . . . 75.35 109.527 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -57.96 -48.68 79.25 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 123.603 0.565 . . . . 75.51 109.648 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.58 77.58 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.885 0.741 . . . . 73.23 111.8 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.9 OUTLIER -72.98 -49.18 30.56 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.612 0.57 . . . . 75.02 110.448 -178.722 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -81.55 -10.68 59.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.757 -0.656 . . . . 72.05 111.765 -172.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' MET . . . . . 0.628 ' SD ' ' HB2' ' A' ' 152' ' ' ARG . 1.5 tmt? -96.24 -59.82 1.75 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.144 -1.058 . . . . 63.04 108.144 173.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.539 HD12 ' HB2' ' A' ' 155' ' ' ASN . 0.1 OUTLIER 40.81 65.69 0.75 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 125.957 1.703 . . . . 61.53 112.341 174.215 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ARG . . . . . 0.628 ' HB2' ' SD ' ' A' ' 150' ' ' MET . 2.0 tmt_? -101.0 -23.47 14.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.52 -0.919 . . . . 75.11 108.52 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -43.78 -49.15 8.14 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.425 1.49 . . . . 70.54 112.001 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -171.68 109.86 0.28 Allowed 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.382 1.051 . . . . 45.24 109.969 169.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' ASN . . . . . 0.539 ' HB2' HD12 ' A' ' 151' ' ' LEU . 50.3 t30 -150.99 104.19 3.12 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.6 0.76 . . . . 74.14 109.451 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 . . . . . 0 CA--C 1.557 1.213 0 C-N-CA 125.645 1.578 . . . . 51.11 112.336 176.268 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 121.638 0.733 . . . . 62.52 110.106 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -69.78 -42.87 73.21 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 74.22 110.179 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 95.7 m-20 -58.45 -46.69 86.05 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.667 -0.697 . . . . 75.04 110.342 174.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 8' ' ' ILE . 42.6 mt -63.78 -40.49 96.8 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.863 0.727 . . . . 54.21 111.134 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -59.52 -48.42 81.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.762 -0.829 . . . . 62.51 108.762 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -66.08 -49.12 68.69 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-O 118.901 -0.571 . . . . 73.13 111.118 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.2 mt -54.42 -47.65 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.831 0.852 . . . . 62.14 111.275 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 4' ' ' LEU . 20.8 mm -66.78 -46.74 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.166 -0.925 . . . . 74.1 110.958 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -63.19 -44.0 96.59 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.536 0.522 . . . . 71.53 110.646 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.8 mt -55.49 -58.93 5.73 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.41 0.684 . . . . 72.54 109.835 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.81 -38.33 95.78 Favored Glycine 0 C--N 1.348 1.245 0 O-C-N 124.443 1.089 . . . . 61.24 114.609 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -70.98 -47.65 57.72 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 123.192 0.597 . . . . 61.05 110.259 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.44 HG12 ' HD2' ' A' ' 17' ' ' ARG . 90.6 t -64.48 -31.35 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 115.631 -0.713 . . . . 71.2 110.01 174.108 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.582 HG12 HD11 ' A' ' 76' ' ' ILE . 14.5 mt -59.02 -49.89 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.946 0.899 . . . . 35.42 109.712 174.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -60.44 -42.49 96.21 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 123.946 0.779 . . . . 74.53 111.322 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -67.11 -58.04 5.64 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.309 0.381 . . . . 73.52 111.456 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.44 ' HD2' HG12 ' A' ' 13' ' ' VAL . 1.4 ptm180 -72.07 -19.78 61.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.742 0.817 . . . . 71.42 112.992 -167.065 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 35.1 t -61.66 -16.04 45.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.919 0.888 . . . . 61.4 112.059 176.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -55.01 -12.81 0.92 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.006 1.113 . . . . 74.42 114.006 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -66.24 -18.73 65.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.381 0.673 . . . . 74.32 112.609 176.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 7.7 mmt -70.55 93.64 0.92 Allowed 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.081 0.467 . . . . 75.51 110.716 -175.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.569 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 11.3 mmmm -68.76 -43.93 74.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.016 0.926 . . . . 73.11 110.252 171.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -101.97 175.05 5.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.833 -1.531 . . . . 55.34 109.546 166.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.494 ' SG ' HG21 ' A' ' 85' ' ' ILE . 83.5 m 58.52 45.04 16.99 Favored 'General case' 0 C--O 1.243 0.735 0 O-C-N 124.095 0.872 . . . . 71.33 110.844 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -74.37 -45.23 48.3 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 114.627 -1.169 . . . . 72.42 110.658 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.9 mtpm? -65.07 -33.5 76.17 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.07 -0.715 . . . . 75.1 109.07 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.463 ' HB2' ' OD1' ' A' ' 144' ' ' ASP . 3.1 tp-100 -55.41 -47.02 76.56 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 123.893 0.746 . . . . 64.0 110.492 170.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 42.5 t -73.98 -21.97 59.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.201 1.0 . . . . 74.52 112.031 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -45.78 53.73 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.426 0.691 . . . . 64.45 109.739 174.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.448 ' NH2' ' HB2' ' A' ' 141' ' ' ALA . 21.9 ttp85 -75.33 -39.32 59.54 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.456 -0.793 . . . . 71.54 110.856 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.7 tp -62.86 -44.44 96.13 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.826 -0.805 . . . . 71.41 108.826 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.21 -52.67 47.98 Favored Glycine 0 C--N 1.349 1.267 0 O-C-N 124.384 1.053 . . . . 74.42 112.025 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -69.45 -34.12 73.93 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.092 0.557 . . . . 54.33 112.424 -177.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.656 HH12 ' HB2' ' A' ' 106' ' ' SER . 14.4 mtt180 -65.45 -58.81 4.92 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.092 -0.707 . . . . 61.3 109.092 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 39' ' ' ILE . 53.3 t -55.89 -44.81 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 124.435 1.084 . . . . 72.14 111.279 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.476 HD23 HD11 ' A' ' 39' ' ' ILE . 75.6 mt -62.14 -38.83 90.46 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.643 0.589 . . . . 63.45 110.666 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -71.89 -20.5 78.83 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.803 -0.443 . . . . 73.34 113.563 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 60.8 mt -85.71 -45.98 11.14 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.044 0.537 . . . . 60.45 111.137 177.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.476 HD11 HD23 ' A' ' 36' ' ' LEU . 14.3 pt -78.34 -43.22 26.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 118.869 -0.586 . . . . 71.44 110.904 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -52.4 -53.65 50.83 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 114.37 1.248 . . . . 72.22 114.37 -173.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.35 -32.64 81.37 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.768 1.645 . . . . 72.01 112.459 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 46' ' ' GLN . 4.3 mm? -75.16 -37.01 61.48 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.757 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HG3' HD12 ' A' ' 8' ' ' ILE . 78.6 mt-10 -67.06 -40.5 87.09 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.585 1.154 . . . . 75.42 111.25 -177.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.0 mmt -60.67 -40.28 91.52 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.984 0.803 . . . . 75.11 110.542 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.9 mt -80.7 -26.33 37.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.615 0.766 . . . . 75.35 111.481 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -74.76 -29.22 61.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.106 0.962 . . . . 63.23 109.942 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -59.28 -34.24 72.04 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.306 0.642 . . . . 75.11 110.899 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -75.27 -55.57 5.58 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.525 -0.917 . . . . 73.22 108.525 169.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 60.74 23.91 61.61 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-N 115.334 -0.848 . . . . 61.13 113.25 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -77.88 171.42 15.01 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.89 0.876 . . . . 71.14 110.587 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -64.22 146.26 54.61 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.183 0.516 . . . . 70.51 111.118 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.3 m -132.13 -157.59 0.83 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 107.92 -1.141 . . . . 53.31 107.92 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 45.2 t -106.07 89.94 4.16 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 108.168 -1.049 . . . . 72.24 108.168 167.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.626 ' HA ' HD12 ' A' ' 58' ' ' LEU . 14.8 Cg_exo -71.04 162.95 40.94 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 122.828 2.352 . . . . 75.12 112.365 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 43.6 t -158.68 160.17 36.14 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.359 0.664 . . . . 72.42 109.806 -173.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.41 -27.85 65.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.69 -0.687 . . . . 44.14 110.602 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -74.2 -30.54 62.25 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.859 0.464 . . . . 71.24 111.028 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.626 HD12 ' HA ' ' A' ' 54' ' ' PRO . 59.1 mt -69.46 -41.77 75.78 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.437 0.461 . . . . 65.34 109.978 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.4 m -61.14 -49.0 79.04 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 124.181 0.925 . . . . 70.1 109.933 175.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 79.9 m -60.98 -40.43 93.43 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.75 0.656 . . . . 74.52 111.24 178.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -62.29 -50.11 72.97 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.684 0.794 . . . . 74.25 110.854 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.6 mmt -72.63 -19.38 61.46 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 115.271 -0.877 . . . . 70.31 112.34 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -78.22 -44.12 26.51 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 122.916 0.486 . . . . 61.43 110.248 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -60.6 -46.18 91.2 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.191 0.996 . . . . 74.11 109.914 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.9 t80 -65.83 -50.92 62.89 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 114.569 -1.196 . . . . 53.02 109.444 -176.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.495 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 ttpm? -54.45 -46.57 73.31 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.455 0.702 . . . . 71.41 111.065 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.99 -43.71 94.99 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 124.038 0.836 . . . . 74.22 111.17 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.57 -39.2 88.36 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.632 -0.713 . . . . 64.11 111.546 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -65.64 -34.15 77.55 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.22 1.008 . . . . 71.01 111.299 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 80.9 mm-40 -61.06 -49.7 76.29 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.313 0.645 . . . . 64.33 109.283 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 33.7 mt-10 -59.32 -44.19 92.61 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.291 -1.322 . . . . 74.33 111.032 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.55 -42.98 99.88 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 123.914 0.759 . . . . 74.55 111.34 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -61.47 -36.42 80.39 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.812 0.695 . . . . 72.52 110.101 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -70.2 -36.72 71.43 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 114.83 -1.077 . . . . 65.44 112.328 177.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 11.5 mm-40 -62.63 -51.43 67.31 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 122.881 0.472 . . . . 52.45 109.774 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.582 HD11 HG12 ' A' ' 14' ' ' ILE . 2.3 pt -74.63 -19.39 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 112.566 0.58 . . . . 73.0 112.566 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.79 -40.63 93.35 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.606 -0.516 . . . . 71.3 109.606 167.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 77.1 mttt -74.77 -45.42 43.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.498 0.719 . . . . 65.11 110.616 175.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.56 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.5 m-30 -73.32 -4.28 32.32 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.116 0.966 . . . . 65.14 112.542 -173.059 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.9 p -57.33 -32.12 66.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.083 0.553 . . . . 72.54 110.234 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -84.43 118.8 24.49 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.149 -0.932 . . . . 72.44 109.265 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.569 ' HG2' ' HB2' ' A' ' 22' ' ' LYS . 4.1 mpt_? -74.14 -31.72 62.86 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.429 1.092 . . . . 74.45 110.046 -176.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.7 m -64.93 -36.05 83.14 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.813 -1.085 . . . . 74.31 111.04 174.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -63.4 -40.7 97.92 Favored 'General case' 0 C--O 1.252 1.185 0 C-N-CA 123.436 0.695 . . . . 74.42 110.532 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 97' ' ' LEU . 21.8 mt -58.91 -55.48 23.08 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 O-C-N 124.133 0.895 . . . . 75.21 109.536 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.7 t -56.22 -40.03 73.41 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.862 0.726 . . . . 65.14 111.911 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.8 -46.09 91.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.92 0.888 . . . . 55.13 111.452 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.28 -22.96 30.54 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 119.552 -0.261 . . . . 73.22 110.648 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 tp -73.3 -36.57 66.3 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.85 0.86 . . . . 75.31 110.662 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -74.65 -14.49 60.76 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.119 -0.946 . . . . 64.22 110.28 175.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -108.82 11.15 26.4 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.541 1.136 . . . . 73.42 110.163 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.7 t -114.12 127.05 55.74 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 124.035 0.934 . . . . 32.43 108.932 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.97 -20.48 24.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.851 0.861 . . . . 74.1 109.968 -178.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -92.93 164.84 13.16 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.921 0.888 . . . . 72.02 111.323 -172.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -85.42 -47.35 10.05 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.672 1.189 . . . . 62.44 111.032 -174.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.427 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.7 mp -81.11 117.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.351 0.645 0 N-CA-C 109.133 -0.692 . . . . 74.51 109.133 -169.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.537 HD11 HG23 ' A' ' 85' ' ' ILE . 12.0 tp -60.68 -30.87 70.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.968 1.307 . . . . 72.01 111.875 -175.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -111.65 13.06 21.21 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.679 -1.153 . . . . 74.11 111.423 -175.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -37.15 -57.86 0.84 Allowed 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 114.512 1.301 . . . . 73.23 114.512 -159.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.476 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 16.3 t70 -54.84 -62.44 1.66 Allowed 'General case' 0 N--CA 1.479 0.983 0 O-C-N 124.432 1.083 . . . . 74.43 110.749 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.03 -49.04 85.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 CA-C-N 114.903 -1.044 . . . . 73.55 111.676 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.7 -28.62 67.01 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.344 0.658 . . . . 65.53 111.331 -175.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -69.65 -34.17 73.64 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.366 -0.605 . . . . 74.13 109.366 172.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.1 mtpt -66.74 -42.64 85.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 119.148 -0.453 . . . . 71.31 110.873 174.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.519 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -59.83 -40.11 87.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 109.762 -0.458 . . . . 75.54 109.762 171.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.656 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.6 t -66.86 -42.53 85.52 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.765 0.666 . . . . 61.33 111.758 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -70.14 -47.63 60.88 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.659 0.783 . . . . 73.4 109.856 -177.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 45.6 t -72.88 -21.7 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.171 -0.922 . . . . 75.24 110.873 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.417 ' HA ' ' HB2' ' A' ' 112' ' ' LEU . 42.5 t-105 -78.54 -35.24 46.44 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 118.469 0.577 . . . . 74.24 110.855 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -57.71 -52.52 65.1 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.616 -0.883 . . . . 70.41 108.616 172.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.488 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 49.7 mt-10 -57.69 -49.3 76.95 Favored 'General case' 0 C--N 1.351 0.631 0 CA-C-N 114.359 -1.291 . . . . 65.2 110.261 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.5 OUTLIER -54.75 -60.5 3.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.512 1.132 . . . . 75.51 109.444 -174.503 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 84.4 p -59.18 -37.19 76.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.269 -0.878 . . . . 64.42 111.501 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.5 -57.29 8.6 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 111.922 0.341 . . . . 72.35 111.922 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 3.6 pp -66.28 -35.28 79.99 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-N 117.982 0.355 . . . . 72.52 111.6 -175.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.546 HD22 ' SD ' ' A' ' 122' ' ' MET . 94.1 mt -67.82 -50.94 53.96 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 123.183 0.593 . . . . 74.4 110.57 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.16 -45.71 69.36 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.118 0.485 . . . . 51.33 112.062 -173.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 94.0 t -84.76 -42.41 16.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-N 115.378 -0.828 . . . . 75.0 111.39 -171.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.5 -57.75 2.31 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 109.47 -0.567 . . . . 41.31 109.47 -175.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -11.85 59.89 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 123.521 0.729 . . . . 72.32 111.308 -174.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 65.57 44.15 3.11 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 125.259 1.424 . . . . 60.52 112.017 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.546 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.5 mtp -110.5 112.63 56.56 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.49 1.116 . . . . 64.3 109.8 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -77.12 67.53 7.59 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.887 2.391 . . . . 71.32 112.061 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.0 m -109.36 94.24 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 C-N-CA 124.41 1.084 . . . . 64.2 110.304 -174.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 26.3 t -164.24 68.04 1.49 Allowed Pre-proline 0 CA--C 1.553 1.068 0 CA-C-N 115.629 -0.714 . . . . 73.1 109.21 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -90.25 4.67 4.61 Favored 'Trans proline' 0 C--N 1.377 2.066 0 C-N-CA 123.088 2.525 . . . . 75.43 114.002 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.495 HD12 ' CZ2' ' A' ' 133' ' ' TRP . 5.5 pt -139.74 84.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.304 0.641 . . . . 73.11 110.625 -170.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' SER . . . . . 0.434 ' HB3' ' HB2' ' A' ' 133' ' ' TRP . 37.6 t 62.34 178.42 0.13 Allowed 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.386 1.074 . . . . 52.04 111.538 177.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -30.21 45.84 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 107.992 -1.114 . . . . 54.31 107.992 170.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 122.0 -17.54 8.63 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.684 -0.689 . . . . 63.44 112.434 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.55 4.95 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.25 0.62 . . . . 63.31 110.673 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 45.9 t -70.9 -27.83 64.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.214 0.606 . . . . 73.35 110.52 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.513 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 5.8 t90 -60.1 -25.3 65.32 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.899 0.879 . . . . 73.42 111.344 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.22 -39.84 20.41 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.736 0.814 . . . . 63.55 111.491 173.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -67.74 -34.31 76.58 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.857 0.863 . . . . 62.33 111.518 -173.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.72 -35.08 70.19 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.47 -1.241 . . . . 74.51 111.024 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.66 -43.45 89.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.157 0.583 . . . . 73.5 111.557 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.47 -59.81 4.3 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.941 0.776 . . . . 74.14 110.259 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.41 -54.18 48.64 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.197 0.936 . . . . 64.53 111.846 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.41 -49.86 75.18 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.195 0.934 . . . . 73.33 110.857 -173.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.448 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . . . -66.71 -31.28 71.84 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 124.159 0.912 . . . . 71.15 111.432 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.27 -52.66 62.81 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 123.636 0.585 . . . . 73.4 110.12 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.27 -36.08 77.0 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.263 0.977 . . . . 71.4 111.458 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.9 t70 -75.73 -50.21 15.98 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.371 1.068 . . . . 72.12 112.045 -172.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -66.03 -33.34 75.59 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.148 -0.686 . . . . 75.22 109.148 175.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -67.35 -32.23 73.03 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.048 0.539 . . . . 62.22 109.988 174.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.59 -21.86 60.2 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.244 0.618 . . . . 64.32 111.335 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -54.91 12.12 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.394 -0.595 . . . . 74.22 109.394 169.303 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.56 -47.52 85.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.386 0.674 . . . . 70.31 111.565 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 40.6 ttm -84.76 -72.74 0.46 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.599 0.76 . . . . 43.34 109.441 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 35.5 tp 64.68 151.51 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.347 1.459 . . . . 53.02 112.331 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -147.68 71.54 1.2 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.42 0.688 . . . . 75.52 109.687 171.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -164.2 -69.14 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.524 -0.762 . . . . 72.23 110.443 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -86.64 -77.44 0.32 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.287 -0.635 . . . . 63.33 109.287 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 17.4 m120 65.37 -171.21 0.19 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.588 1.155 . . . . 73.11 112.458 173.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 C--O 1.249 1.056 0 C-N-CA 124.518 1.127 . . . . 62.1 109.255 177.635 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 ttm . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 111.487 0.181 . . . . 71.23 111.487 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -34.37 73.08 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 122.903 0.481 . . . . 72.34 110.605 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.636 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 16.4 m120 -59.15 -59.7 5.04 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 123.891 0.745 . . . . 65.11 109.934 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.486 ' O ' HG12 ' A' ' 8' ' ' ILE . 56.8 mt -61.91 -39.53 92.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 124.29 0.994 . . . . 72.22 112.165 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.28 -48.06 81.66 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.431 0.692 . . . . 60.41 109.91 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -72.38 -41.57 66.2 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-O 118.766 -0.635 . . . . 55.43 111.528 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.6 mt -52.56 -49.26 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.648 0.779 . . . . 74.42 110.673 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 4' ' ' LEU . 28.6 mm -71.69 -41.53 71.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 114.685 -1.143 . . . . 63.53 111.202 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -61.51 -59.12 5.72 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 122.893 0.477 . . . . 73.33 110.053 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.411 ' O ' HG13 ' A' ' 14' ' ' ILE . 27.2 mt -52.06 -49.4 63.55 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.309 1.044 . . . . 64.04 111.517 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.49 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -64.08 -39.05 96.83 Favored Glycine 0 C--N 1.351 1.383 0 O-C-N 123.955 0.785 . . . . 44.41 114.081 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -69.47 -44.26 71.55 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 109.284 -0.636 . . . . 72.52 109.284 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.467 HG12 ' HD2' ' A' ' 17' ' ' ARG . 69.5 t -61.88 -31.35 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.2 1.0 . . . . 74.21 111.013 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.507 HG21 HG21 ' A' ' 35' ' ' VAL . 68.3 mt -61.03 -53.26 51.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 109.047 -0.723 . . . . 70.34 109.047 172.234 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -58.33 -30.61 66.84 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 123.884 0.74 . . . . 72.4 112.142 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -76.45 -51.44 11.78 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.893 0.477 . . . . 73.32 111.672 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.467 ' HD2' HG12 ' A' ' 13' ' ' VAL . 9.7 ptm180 -84.47 -19.53 33.21 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.977 0.511 . . . . 74.14 112.235 -169.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.521 ' SG ' HD23 ' A' ' 31' ' ' LEU . 21.8 t -71.17 -19.84 62.36 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.499 0.72 . . . . 74.04 110.413 177.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -63.88 -13.17 42.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.284 0.634 . . . . 74.52 111.675 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -28.54 70.14 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.491 0.717 . . . . 65.22 110.247 174.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.6 mmt -70.31 89.24 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.126 0.571 . . . . 74.01 110.138 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -77.81 -24.01 48.9 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.299 -1.0 . . . . 64.12 108.299 170.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.536 ' HD1' ' HG2' ' A' ' 82' ' ' ARG . 83.8 m-85 -104.23 171.79 7.15 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.624 1.17 . . . . 74.33 109.461 167.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.649 ' SG ' HG21 ' A' ' 85' ' ' ILE . 57.9 m 53.01 49.92 19.1 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 124.093 0.87 . . . . 61.5 110.936 -175.508 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 51.1 pttt -61.5 -49.68 75.78 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 113.726 -1.579 . . . . 72.12 111.904 -174.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.574 ' HB3' ' HB2' ' A' ' 140' ' ' ASP . 28.6 mmtp -67.31 -45.26 77.05 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.544 0.337 . . . . 71.03 111.648 -174.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.82 -33.14 75.16 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.114 0.565 . . . . 74.4 110.999 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 21.5 t -75.72 -38.51 58.5 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.938 0.895 . . . . 72.41 111.849 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 25' ' ' LYS . 50.9 mtp85 -66.86 -41.8 86.75 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.798 -0.445 . . . . 73.14 109.798 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 32.3 ttp85 -63.04 -47.83 81.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.32 -0.854 . . . . 72.31 110.84 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.521 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.2 tp -55.08 -57.73 10.52 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.677 0.61 . . . . 70.22 110.776 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -42.95 98.46 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.061 0.85 . . . . 71.33 113.571 -177.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -60.02 -46.39 89.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.314 0.646 . . . . 65.25 111.514 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.515 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 70.2 mtt-85 -61.55 -53.83 51.16 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.837 0.71 . . . . 75.42 110.333 178.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.507 HG21 HG21 ' A' ' 14' ' ' ILE . 77.1 t -53.62 -43.54 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 124.168 0.918 . . . . 71.45 111.415 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 39' ' ' ILE . 72.5 mt -63.4 -46.16 87.69 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 123.695 0.622 . . . . 63.41 111.147 177.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.94 -22.81 65.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.084 -0.507 . . . . 52.32 113.31 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.573 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 36.6 mt -87.0 -42.55 13.02 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.452 0.701 . . . . 64.2 112.546 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 36' ' ' LEU . 18.7 pt -80.94 -40.14 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 112.096 0.406 . . . . 73.44 112.096 -172.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -57.55 -44.04 99.29 Favored Pre-proline 0 N--CA 1.486 1.374 0 N-CA-C 114.257 1.206 . . . . 70.35 114.257 -173.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 13.5 Cg_endo -55.94 -31.84 83.32 Favored 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 122.325 2.016 . . . . 60.11 112.609 174.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.447 HD13 HD21 ' A' ' 45' ' ' LEU . 3.3 mm? -83.25 -29.87 28.1 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.044 -0.526 . . . . 73.44 110.383 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.54 -31.84 72.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.985 0.514 . . . . 62.43 110.837 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.5 mtm -65.89 -45.84 80.55 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 123.423 0.452 . . . . 63.04 111.556 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 HD13 ' A' ' 42' ' ' LEU . 4.3 pp -76.35 -26.97 56.27 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.277 0.231 . . . . 73.12 111.167 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -64.3 -42.49 96.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.121 0.969 . . . . 72.13 109.704 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.48 -37.55 86.39 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.475 -1.239 . . . . 45.43 110.599 175.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -71.24 -30.01 65.8 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 116.005 -0.543 . . . . 54.44 111.071 175.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.17 31.83 78.32 Favored Glycine 0 C--N 1.356 1.654 0 O-C-N 123.684 0.615 . . . . 40.05 113.822 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -74.33 143.46 44.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.241 0.46 . . . . 72.02 112.241 -172.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -64.92 89.13 0.07 Allowed 'General case' 0 C--N 1.356 0.862 0 C-N-CA 124.266 1.027 . . . . 65.31 110.476 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.2 p -81.38 153.52 26.93 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.545 -0.752 . . . . 72.52 109.319 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.46 100.71 14.58 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 108.903 -0.777 . . . . 72.34 108.903 175.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -75.07 85.5 1.53 Allowed 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 122.399 2.066 . . . . 70.42 110.431 173.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.3 t -68.09 179.22 1.58 Allowed 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.156 -1.383 . . . . 64.44 110.0 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -54.22 -56.9 13.76 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.389 0.676 . . . . 72.32 110.147 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE3' ' HG3' ' A' ' 119' ' ' GLU . 47.0 pttt -68.77 -31.24 70.13 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.278 -0.874 . . . . 64.34 112.639 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.442 HD22 HD13 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -65.88 -55.74 15.44 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 108.702 -0.851 . . . . 71.23 108.702 -178.124 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 m -67.5 -36.05 80.33 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.2 -0.909 . . . . 74.43 111.372 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 100.0 m -62.31 -45.99 90.74 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 123.266 0.354 . . . . 62.44 110.962 177.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.78 94.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 123.571 0.544 . . . . 63.01 110.459 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.636 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 24.8 mmt -68.38 -25.97 65.33 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-N 115.588 -0.733 . . . . 63.22 112.252 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -75.7 -45.65 35.63 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.788 0.835 . . . . 73.42 110.269 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -62.88 -42.42 99.76 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.261 1.025 . . . . 61.21 110.245 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.573 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 6.3 t80 -67.03 -52.57 40.79 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 114.903 -1.044 . . . . 74.14 109.297 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.61 -47.12 63.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.41 1.084 . . . . 73.43 110.635 177.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.3 90.77 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.982 0.801 . . . . 42.04 111.486 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -65.19 -38.37 90.27 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.832 0.853 . . . . 65.11 111.512 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -63.37 -35.16 79.47 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.829 0.852 . . . . 71.12 111.046 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -68.69 -38.78 80.59 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.86 0.464 . . . . 74.22 111.171 175.043 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -59.24 -49.32 78.29 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 123.478 0.486 . . . . 74.14 109.954 176.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.74 -52.16 66.66 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.222 0.951 . . . . 41.42 111.634 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.44 -45.61 80.7 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.582 1.153 . . . . 73.12 111.758 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.38 -38.83 91.49 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.81 -1.086 . . . . 52.31 112.874 -176.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -76.84 -37.26 55.97 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.221 -0.895 . . . . 62.12 112.183 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -65.38 -32.53 58.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.492 1.042 . . . . 64.44 110.505 171.297 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.66 -47.5 84.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.323 -0.621 . . . . 63.4 109.323 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -71.6 -27.94 63.47 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.085 0.554 . . . . 44.11 112.248 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.77 4.51 36.58 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.743 0.817 . . . . 74.32 111.886 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.7 p -58.96 -26.44 64.43 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.019 0.438 . . . . 51.43 111.201 175.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -79.23 108.15 12.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.274 -1.01 . . . . 75.44 108.274 165.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.536 ' HG2' ' HD1' ' A' ' 23' ' ' TYR . 2.3 mpt_? -71.34 -24.08 62.04 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.28 0.632 . . . . 75.03 109.924 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.9 m -67.43 -35.74 79.85 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.724 0.81 . . . . 60.04 111.246 172.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.85 -41.0 99.18 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.051 0.94 . . . . 73.14 110.067 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 24' ' ' CYS . 46.8 mt -59.73 -59.08 4.49 Favored 'Isoleucine or valine' 0 C--N 1.352 0.715 0 CA-C-N 114.754 -1.112 . . . . 75.23 109.671 175.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.46 -33.48 65.95 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.176 0.59 . . . . 74.41 111.999 -178.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -60.04 -53.66 55.23 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.36 1.064 . . . . 70.14 111.258 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -77.96 -26.79 48.99 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 122.306 -0.246 . . . . 70.34 110.458 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.537 ' HG ' ' HG2' ' A' ' 145' ' ' ARG . 10.5 tp -72.7 -36.51 67.86 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.811 0.844 . . . . 75.33 110.951 -169.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.7 t -67.53 -30.67 70.38 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.664 -0.698 . . . . 74.54 110.605 175.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.25 -3.48 57.78 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.142 0.977 . . . . 51.12 110.936 177.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 t -94.39 126.68 39.81 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.095 0.958 . . . . 63.44 110.485 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -90.92 -44.45 9.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.748 0.819 . . . . 74.22 109.391 171.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -147.62 7.99 0.87 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.297 1.039 . . . . 73.23 111.333 -175.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -75.24 84.21 2.41 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 108.208 -1.034 . . . . 65.42 108.208 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 22.2 mm -63.72 146.26 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 114.696 -1.138 . . . . 73.42 108.464 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -36.99 -54.17 0.95 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 125.714 1.606 . . . . 61.1 112.232 -178.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 52.9 m-85 -128.49 42.37 3.33 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 114.97 -1.014 . . . . 74.25 112.006 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.566 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 4.9 tmtm? -58.58 -61.1 2.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 119.512 1.051 . . . . 71.24 109.916 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.83 -41.03 92.29 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.287 -0.869 . . . . 54.34 111.626 -174.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.7 t -67.86 -43.63 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 123.513 0.508 . . . . 72.3 110.851 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.427 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 19.4 t30 -61.41 -38.88 88.72 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.563 -0.744 . . . . 74.51 110.269 174.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -31.89 72.8 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.033 0.533 . . . . 72.44 109.801 177.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.81 -56.68 10.63 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.154 0.582 . . . . 74.42 109.878 174.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.8 mp -55.3 -38.87 69.22 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.688 0.618 . . . . 40.3 111.008 178.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.2 t -73.66 -49.07 27.75 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.527 0.731 . . . . 73.52 111.888 -174.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.41 -48.59 74.83 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.44 0.696 . . . . 74.02 109.674 -177.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.1 t -64.52 -37.12 79.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 CA-C-N 114.968 -1.015 . . . . 74.52 110.516 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.42 ' HZ3' HD21 ' A' ' 42' ' ' LEU . 61.2 t-105 -60.97 -38.65 86.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.56 0.344 . . . . 75.44 111.497 176.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.0 -56.9 16.3 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.118 -0.697 . . . . 74.4 109.118 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -55.27 -44.69 75.84 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.199 0.937 . . . . 70.32 111.16 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.427 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.4 tt -69.82 -53.4 18.38 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.29 1.436 . . . . 74.43 110.796 -171.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.5 t -63.64 -36.02 82.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.371 0.668 . . . . 65.4 110.998 -179.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.54 -53.54 54.96 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.563 0.539 . . . . 70.4 111.155 176.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.442 HD13 HD22 ' A' ' 58' ' ' LEU . 3.9 pp -70.05 -24.42 63.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.089 -0.382 . . . . 71.12 111.796 -177.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.17 -43.14 71.45 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.297 0.239 . . . . 62.24 111.149 173.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.54 -23.06 40.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.509 0.559 . . . . 70.03 112.509 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.96 -50.13 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.407 0.283 . . . . 53.32 111.203 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.454 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 24.8 mm-40 -81.34 -56.76 3.84 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.924 0.392 . . . . 74.21 110.883 -176.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -86.72 -1.36 57.66 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 115.647 -0.706 . . . . 74.12 110.83 -175.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.7 mmt180 65.52 19.01 11.46 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.173 1.389 . . . . 73.14 113.331 170.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 50.9 mtp -70.64 143.05 89.37 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.708 0.803 . . . . 71.53 112.01 -173.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -83.15 24.98 0.71 Allowed 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.464 2.109 . . . . 74.52 113.194 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 16.9 m -75.17 115.83 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-O 121.46 0.648 . . . . 61.44 111.932 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 24.3 t -166.95 65.49 0.82 Allowed Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 114.491 -1.232 . . . . 64.03 108.265 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.432 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 42.9 Cg_endo -87.39 28.88 0.5 Allowed 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 123.526 2.818 . . . . 62.12 111.911 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 6.7 tt -146.55 152.43 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.024 1.33 . . . . 75.44 108.101 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.4 m -83.31 -158.69 0.3 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 122.95 0.5 . . . . 42.12 110.052 172.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -62.8 -37.96 88.81 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.673 0.789 . . . . 73.03 111.62 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 122.13 1.91 10.25 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-O 119.538 -0.59 . . . . 75.21 113.533 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.13 97.83 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.481 0.712 . . . . 51.2 111.603 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' A' ' 136' ' ' GLU . 31.6 m -66.76 -39.79 88.02 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.725 -0.67 . . . . 75.34 110.179 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.8 m0 -62.79 -18.03 62.08 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.307 0.854 . . . . 73.23 113.307 -178.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.91 -41.35 19.01 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.149 0.5 . . . . 45.52 110.69 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -80.78 -23.76 39.08 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.134 0.79 . . . . 61.14 113.134 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 132' ' ' SER . 76.8 mt-10 -62.29 -53.69 51.47 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.477 0.486 . . . . 73.5 109.732 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.97 -61.82 1.86 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.95 1.406 . . . . 75.32 111.563 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -60.54 -41.04 93.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 123.529 0.518 . . . . 54.13 112.304 -179.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 34.1 tt0 -67.87 -63.29 1.09 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 118.035 0.379 . . . . 61.32 111.746 -175.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 2.6 p30 -73.4 -30.58 63.36 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.276 -0.392 . . . . 72.21 111.623 -171.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.55 -23.06 50.18 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-O 119.117 -0.468 . . . . 55.4 111.453 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -60.51 -51.95 67.27 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.588 -0.893 . . . . 64.0 108.588 164.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 36.9 mt-10 -59.44 -40.47 86.9 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 124.085 0.865 . . . . 53.04 111.528 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 14.2 t0 -79.75 -45.97 17.87 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.16 0.984 . . . . 72.01 110.962 -168.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.537 ' HG2' ' HG ' ' A' ' 89' ' ' LEU . 4.3 tmt_? -62.73 -42.98 99.93 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.191 0.997 . . . . 55.51 109.158 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -67.45 -34.24 76.79 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.626 -0.716 . . . . 74.51 111.027 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.25 -24.9 54.55 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.525 0.33 . . . . 53.22 111.847 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.06 -36.75 35.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.845 0.458 . . . . 64.25 110.043 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -80.51 -41.18 24.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.092 0.557 . . . . 73.22 112.042 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.4 tpt -102.54 55.97 0.78 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 107.076 -1.453 . . . . 65.13 107.076 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.422 HD21 ' HE2' ' A' ' 23' ' ' TYR . 42.3 tp -82.8 87.38 6.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 114.052 -1.431 . . . . 71.51 111.156 -168.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -123.33 66.45 1.0 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.261 -1.014 . . . . 72.21 108.261 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.2 tpp85 -167.4 -49.44 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 114.344 -1.298 . . . . 63.11 109.79 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -132.05 34.17 3.84 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.575 -0.739 . . . . 73.33 110.453 -169.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -69.58 98.38 1.14 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.859 0.464 . . . . 74.25 109.888 -179.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 . . . . . 0 C--O 1.249 1.078 0 C-N-CA 125.432 1.493 . . . . 52.31 111.235 -176.071 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 112.227 0.454 . . . . 75.21 112.227 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -71.91 -26.38 62.29 Favored 'General case' 0 C--N 1.36 1.032 0 CA-C-N 118.222 0.464 . . . . 74.34 110.238 173.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -59.09 -51.51 69.73 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.789 -0.449 . . . . 73.03 109.789 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.61 -36.7 81.49 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 124.063 0.852 . . . . 65.52 111.375 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -57.53 -47.63 81.48 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 123.532 0.52 . . . . 71.34 109.784 176.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.98 -47.99 78.21 Favored 'General case' 0 C--O 1.212 -0.915 0 O-C-N 123.886 0.741 . . . . 74.31 110.977 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.13 -49.37 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 123.999 0.92 . . . . 73.33 111.313 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.3 mm -71.31 -43.81 73.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 CA-C-N 115.141 -0.936 . . . . 70.32 111.049 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -62.49 -51.19 68.43 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 122.874 0.469 . . . . 70.14 109.987 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -54.33 -46.48 72.89 Favored 'General case' 0 C--O 1.208 -1.116 0 O-C-N 124.453 1.095 . . . . 75.33 110.548 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.44 -52.95 49.77 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 124.332 1.02 . . . . 64.23 113.828 -177.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.41 ' HG3' HD12 ' A' ' 39' ' ' ILE . 27.3 mt-30 -66.25 -40.72 90.4 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 122.842 0.457 . . . . 65.22 111.2 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.44 -37.75 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.885 0.874 . . . . 73.11 110.427 174.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.516 HD11 ' O ' ' A' ' 69' ' ' LEU . 17.0 mt -59.24 -50.8 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.663 1.185 . . . . 71.53 109.804 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -56.97 -43.86 82.04 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.354 1.034 . . . . 75.2 111.286 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.69 -49.41 71.01 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.033 0.533 . . . . 73.04 112.141 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.536 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 10.4 ptm180 -81.8 -16.44 50.92 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.495 0.554 . . . . 64.11 112.495 -174.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 38.5 t -69.03 -19.84 64.12 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.515 0.726 . . . . 75.15 110.775 173.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.13 1.93 6.66 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.48 0.712 . . . . 74.34 112.154 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -65.95 -32.1 73.39 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.246 0.618 . . . . 61.52 111.064 165.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.46 ' SD ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -71.4 86.04 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.824 0.449 . . . . 63.52 110.897 -176.837 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -71.31 -47.4 56.93 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 106.7 -1.593 . . . . 72.33 106.7 170.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.438 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.8 m-85 -91.53 142.98 27.06 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.358 -1.349 . . . . 71.41 107.358 164.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.531 ' SG ' HG21 ' A' ' 85' ' ' ILE . 38.9 m 63.34 46.05 4.63 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 124.248 0.967 . . . . 75.01 110.247 -160.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 28' ' ' CYS . 56.9 pttt -70.07 -44.29 69.42 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.78 -1.555 . . . . 74.3 111.511 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.721 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 45.1 mtpt -74.22 -26.87 60.5 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 119.178 -0.439 . . . . 74.23 109.83 -178.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -31.22 71.83 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.649 0.593 . . . . 71.44 109.969 171.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.652 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 9.0 t -67.18 -43.63 81.72 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.638 0.775 . . . . 62.44 111.432 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -76.39 -24.84 54.09 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-O 119.84 -0.124 . . . . 73.53 111.027 176.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 4.1 tpm_? -65.09 -59.08 4.52 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.547 -0.909 . . . . 74.34 108.547 176.042 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 ' SG ' ' A' ' 18' ' ' CYS . 58.3 tp -61.5 -47.42 85.72 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 124.731 1.27 . . . . 51.21 110.615 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.59 -54.74 34.59 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 124.076 0.86 . . . . 54.12 113.67 -174.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -67.01 -32.51 73.79 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.323 0.649 . . . . 73.25 110.617 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 30' ' ' ARG . 1.7 mtt-85 -56.3 -56.93 14.97 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 123.858 0.724 . . . . 73.32 110.645 173.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 31' ' ' LEU . 65.2 t -60.97 -43.22 95.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 CA-C-N 114.156 -1.384 . . . . 74.2 110.559 -175.077 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.47 -50.42 74.01 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.865 0.466 . . . . 55.23 110.939 177.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.34 -18.63 69.71 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 115.379 -0.828 . . . . 73.44 113.557 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.9 -52.56 5.92 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.771 0.828 . . . . 74.15 110.259 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.41 HD12 ' HG3' ' A' ' 12' ' ' GLN . 16.2 pt -75.89 -32.84 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 118.761 -0.638 . . . . 74.2 111.977 -167.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 44' ' ' MET . 92.7 mttt -58.15 -49.56 92.91 Favored Pre-proline 0 CA--C 1.561 1.401 0 CA-C-O 117.609 -1.186 . . . . 72.14 112.506 -178.199 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -45.65 -43.37 18.53 Favored 'Trans proline' 0 C--N 1.401 3.306 0 C-N-CA 122.932 2.421 . . . . 72.4 113.485 169.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -71.05 -38.72 72.53 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.653 0.381 . . . . 52.3 111.19 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 47.7 mt-10 -67.42 -20.89 65.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.794 0.438 . . . . 75.13 111.085 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 28.3 mmt -68.55 -55.8 10.46 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 110.008 -0.367 . . . . 70.44 110.008 173.272 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.682 HD23 ' SD ' ' A' ' 122' ' ' MET . 2.6 pp -70.25 -21.49 62.98 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 111.623 0.231 . . . . 64.4 111.623 179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.3 tm0? -80.44 -33.33 36.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.014 0.926 . . . . 44.52 110.35 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.55 -42.92 70.52 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.597 -0.52 . . . . 72.01 109.597 178.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.89 2.62 25.81 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.258 -0.883 . . . . 74.13 110.571 170.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.31 95.86 0.07 OUTLIER Glycine 0 C--N 1.351 1.377 0 C-N-CA 124.35 0.976 . . . . 62.31 113.312 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -146.34 141.77 27.59 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 125.141 1.377 . . . . 73.23 107.455 172.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 64.23 96.81 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.547 1.139 . . . . 74.04 109.955 -171.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 9.9 m -72.77 148.92 44.12 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.151 0.58 . . . . 72.23 111.134 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.6 p -147.79 63.36 7.59 Favored Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.569 0.748 . . . . 70.24 109.089 172.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.476 ' HA ' HD23 ' A' ' 58' ' ' LEU . 95.6 Cg_endo -84.51 88.86 0.96 Allowed 'Trans proline' 0 C--N 1.38 2.196 0 C-N-CA 121.74 1.626 . . . . 71.41 110.651 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.4 p -64.85 163.34 14.47 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.175 -0.921 . . . . 60.11 109.833 175.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -52.8 -46.53 67.69 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.439 0.696 . . . . 74.01 112.549 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -64.07 -39.49 94.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.737 0.815 . . . . 61.21 111.568 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' A' ' 54' ' ' PRO . 41.1 tp -73.97 -35.55 64.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.11 0.964 . . . . 74.22 110.423 -175.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 m -66.54 -49.69 65.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.942 0.897 . . . . 54.14 109.077 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.436 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 32.3 m -61.04 -38.31 85.69 Favored 'General case' 0 C--N 1.356 0.862 0 O-C-N 124.06 0.85 . . . . 73.01 110.482 178.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.485 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.4 -45.65 83.15 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 123.565 0.746 . . . . 72.33 110.611 -179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.3 mmt -70.17 -24.96 63.23 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 123.821 0.701 . . . . 73.11 111.666 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -71.79 -46.23 58.98 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.218 0.607 . . . . 73.3 110.173 174.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.3 mtt180 -62.44 -38.25 89.02 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.753 0.821 . . . . 73.11 110.311 175.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.1 t80 -63.32 -59.71 4.35 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 113.704 -1.589 . . . . 74.42 109.192 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 25.2 ttpp -56.17 -44.12 79.04 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 124.561 1.163 . . . . 62.34 110.697 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.28 82.65 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 124.258 0.974 . . . . 62.32 112.142 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -68.86 -39.19 79.99 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.511 0.725 . . . . 52.31 111.418 178.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.516 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -68.53 -31.18 70.24 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.713 0.805 . . . . 73.41 111.131 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 55.3 mt-10 -67.44 -43.42 81.19 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.646 -0.501 . . . . 61.51 109.646 174.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.72 -38.97 92.81 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.127 -0.942 . . . . 75.25 111.06 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.13 -44.96 86.97 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.413 0.685 . . . . 52.03 110.578 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -59.8 -41.6 91.56 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 124.328 1.017 . . . . 63.01 110.658 176.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.87 -37.09 91.99 Favored Glycine 0 C--N 1.35 1.307 0 CA-C-N 115.438 -0.801 . . . . 73.1 113.107 177.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.58 -52.2 62.04 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 122.832 0.453 . . . . 75.4 110.458 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.445 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -70.61 -20.0 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 N-CA-C 112.616 0.598 . . . . 74.54 112.616 178.982 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.536 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 3.3 tm-20 -67.32 -43.37 81.8 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.344 -0.613 . . . . 74.35 109.344 170.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -69.38 -40.87 77.17 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.973 0.909 . . . . 73.43 111.416 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 13.9 m-85 -80.8 0.34 35.28 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.078 0.951 . . . . 74.41 112.511 -173.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -56.43 -32.29 64.76 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.368 0.604 . . . . 71.12 109.859 174.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -82.62 112.23 19.31 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 114.858 -1.065 . . . . 70.11 109.441 168.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -74.9 -24.35 58.52 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.775 0.83 . . . . 73.03 110.566 -177.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -67.48 -37.55 83.05 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.078 0.951 . . . . 63.23 111.076 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.55 -46.22 89.51 Favored 'General case' 0 C--O 1.255 1.37 0 C-N-CA 124.098 0.959 . . . . 71.0 110.076 173.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 97' ' ' LEU . 34.2 mt -58.31 -56.29 17.08 Favored 'Isoleucine or valine' 0 C--N 1.358 0.942 0 CA-C-N 114.573 -1.194 . . . . 61.34 109.956 177.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.3 t -53.91 -39.92 66.24 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.675 1.19 . . . . 33.43 111.612 -176.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -61.04 -54.1 48.94 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 124.544 1.153 . . . . 75.05 111.026 179.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -22.86 53.42 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 116.306 -0.407 . . . . 71.42 111.051 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.1 tp -80.75 -33.77 34.82 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.099 0.96 . . . . 65.13 110.888 -172.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.7 t -72.75 -20.22 61.23 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 121.125 0.488 . . . . 54.11 109.992 172.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.34 8.9 43.67 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.48 1.112 . . . . 43.34 111.244 174.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' A' ' 95' ' ' LYS . 67.6 m -151.26 90.53 1.6 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.612 1.165 . . . . 61.4 109.466 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -77.99 -47.33 18.74 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.715 0.635 . . . . 74.52 112.715 -165.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.09 -22.05 15.35 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.711 -0.477 . . . . 72.14 109.711 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.763 ' HB3' ' HB3' ' A' ' 92' ' ' SER . 36.5 ttmt -58.48 117.68 4.76 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 124.678 1.236 . . . . 63.13 111.046 -173.422 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.99 143.22 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.657 -1.156 . . . . 75.32 108.217 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.644 HD11 HG23 ' A' ' 85' ' ' ILE . 4.5 tp -58.13 -30.51 66.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.928 0.714 . . . . 72.04 112.928 -168.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -119.63 17.88 12.76 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-O 118.159 -0.924 . . . . 70.2 110.645 -176.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.637 ' HG2' ' HG3' ' A' ' 95' ' ' LYS . 0.0 OUTLIER -36.3 -53.32 0.83 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 115.024 1.491 . . . . 73.5 115.024 -160.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASP . . . . . 0.46 ' N ' ' HD3' ' A' ' 99' ' ' LYS . 30.6 m-20 -71.3 -50.75 29.34 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 118.648 0.658 . . . . 73.14 111.564 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.92 -52.82 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 123.944 0.898 . . . . 54.21 111.18 -176.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -63.78 -36.88 85.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.334 1.054 . . . . 75.34 110.998 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -62.71 -32.26 73.33 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.197 0.599 . . . . 64.14 110.717 172.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 98.9 mttt -70.99 -39.74 72.27 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 119.348 -0.358 . . . . 55.41 110.214 174.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.2 -44.61 88.18 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.603 -0.517 . . . . 73.54 109.603 172.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.4 m -63.11 -50.42 70.57 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.015 0.926 . . . . 60.53 111.347 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 37.6 t70 -73.56 -44.05 58.35 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 115.128 -0.942 . . . . 74.44 111.184 -171.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 93.8 t -64.06 -36.48 77.0 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 118.843 -0.598 . . . . 72.42 109.416 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -64.21 -44.71 91.08 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 119.088 -0.482 . . . . 74.14 112.055 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 129' ' ' GLN . 8.5 ptmm? -64.78 -44.31 90.42 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 118.568 0.622 . . . . 51.12 110.378 177.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 11.9 mm-40 -60.8 -41.04 94.86 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.044 0.449 . . . . 61.11 111.076 176.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.6 tp -61.57 -59.96 4.42 Favored 'General case' 0 C--O 1.215 -0.726 0 C-N-CA 124.633 1.173 . . . . 72.33 107.941 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 33.0 t -55.82 -41.22 73.88 Favored 'General case' 0 C--N 1.35 0.601 0 O-C-N 124.557 1.16 . . . . 70.52 111.402 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 81.0 mt -57.7 -54.88 41.87 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.886 0.741 . . . . 71.33 111.481 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.21 -23.74 63.93 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 122.497 -0.127 . . . . 63.14 111.185 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.614 HD13 ' SD ' ' A' ' 122' ' ' MET . 95.8 mt -73.86 -28.38 61.55 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.769 0.828 . . . . 74.42 111.038 174.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 113' ' ' SER . 27.6 mm-40 -71.94 -43.67 64.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.025 0.53 . . . . 74.42 109.639 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.84 -50.07 26.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 116.036 -0.529 . . . . 64.32 112.046 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . 0.417 ' HB2' ' OE1' ' A' ' 120' ' ' GLN . 8.6 mm-40 -82.61 -57.61 3.26 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 111.936 0.347 . . . . 75.3 111.936 -171.439 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.417 ' OE1' ' HB2' ' A' ' 119' ' ' GLU . 24.5 mp0 -89.14 -29.85 19.04 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.519 0.328 . . . . 73.23 111.559 -176.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 56.39 61.84 2.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.465 1.106 . . . . 71.12 110.92 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.682 ' SD ' HD23 ' A' ' 45' ' ' LEU . 22.4 ptm -91.32 147.17 34.88 Favored Pre-proline 0 N--CA 1.476 0.843 0 CA-C-N 114.569 -1.196 . . . . 73.31 108.109 172.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -60.82 -63.2 0.11 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.225 1.95 . . . . 71.15 113.264 -174.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.454 HG23 ' HG3' ' A' ' 122' ' ' MET . 16.2 t 59.24 48.58 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 CA-C-O 122.52 1.152 . . . . 71.04 109.394 -171.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -67.04 -49.99 43.83 Favored Pre-proline 0 CA--C 1.569 1.691 0 CA-C-N 114.747 -1.115 . . . . 64.34 113.966 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -75.51 7.76 2.92 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 122.017 1.812 . . . . 70.12 114.771 -167.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.4 HD11 ' CZ2' ' A' ' 133' ' ' TRP . 15.2 tt -155.96 -27.58 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 N-CA-C 112.966 0.728 . . . . 43.14 112.966 -172.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t 70.64 -74.28 0.09 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.475 1.11 . . . . 73.52 111.2 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.447 ' HB2' ' HA ' ' A' ' 110' ' ' LYS . 0.8 OUTLIER -162.82 18.92 0.08 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.019 0.928 . . . . 74.51 110.665 176.972 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 90.33 49.51 3.23 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 115.765 -0.652 . . . . 74.23 112.513 -175.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -71.79 -54.21 10.9 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.26 0.624 . . . . 72.22 110.393 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.3 m -62.59 -33.03 74.14 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.052 -0.976 . . . . 74.44 111.561 178.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.4 ' CZ2' HD11 ' A' ' 127' ' ' ILE . 27.4 m0 -52.02 -48.49 64.48 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.966 1.306 . . . . 71.22 113.141 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.43 -27.89 40.17 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.056 0.762 . . . . 20.4 113.056 -174.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -88.13 -43.25 11.8 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.121 0.569 . . . . 73.14 110.638 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.405 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 45.3 mt-10 -59.59 -34.69 73.06 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.2 1.0 . . . . 73.3 112.778 -177.076 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 55.8 m-20 -61.25 -64.39 0.97 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.338 0.655 . . . . 73.21 109.885 -176.169 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -61.45 -43.98 97.91 Favored 'General case' 0 C--O 1.213 -0.824 0 O-C-N 124.059 0.849 . . . . 64.45 110.864 -178.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.9 tm0? -64.88 -60.22 3.32 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.399 0.68 . . . . 61.43 110.878 -171.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -67.46 -43.91 79.92 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-N 114.906 -1.043 . . . . 71.23 111.023 -173.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.88 -32.35 72.78 Favored 'General case' 0 C--N 1.358 0.955 0 CA-C-N 116.103 -0.499 . . . . 43.53 111.945 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 31.2 t70 -65.8 -47.63 74.45 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.541 0.526 . . . . 71.14 110.569 176.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -58.51 -41.41 85.34 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 124.108 0.88 . . . . 50.42 111.18 177.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.4 t0 -64.96 -42.81 94.26 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.762 0.825 . . . . 63.54 111.724 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -62.36 -37.56 86.15 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.331 -0.849 . . . . 61.25 109.743 175.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 97.9 mtt180 -62.63 -43.07 99.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.837 0.455 . . . . 74.11 109.926 174.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.61 -22.13 62.57 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.018 0.824 . . . . 44.2 111.91 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.2 OUTLIER -81.72 -55.64 4.51 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 122.981 0.512 . . . . 75.54 110.022 176.086 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -69.32 -61.38 1.81 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.524 -0.762 . . . . 75.23 110.026 -175.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.3 ttm -86.06 72.14 10.47 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.269 -1.382 . . . . 74.5 107.269 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp -73.74 88.8 1.76 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.373 -0.831 . . . . 64.3 109.668 -178.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -110.01 60.47 0.6 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.36 -0.978 . . . . 72.54 108.36 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -159.83 -47.77 0.05 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 114.539 -1.21 . . . . 71.52 109.552 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -118.76 164.41 15.42 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.527 0.731 . . . . 55.55 109.77 -176.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -153.83 80.62 1.15 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 107.925 -1.139 . . . . 74.2 107.925 175.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.25 1.121 0 C-N-CA 124.159 0.984 . . . . 64.23 109.473 -175.08 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.3 ttp . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 118.315 -0.85 . . . . 70.44 111.748 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -42.49 -56.71 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 113.836 1.05 . . . . 74.0 113.836 -167.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -61.33 -40.0 92.6 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.821 0.448 . . . . 63.44 112.08 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -68.8 -38.18 79.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.284 0.564 . . . . 72.11 109.66 -177.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -68.61 -34.48 75.85 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.081 0.952 . . . . 73.45 108.932 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -66.31 -37.94 86.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.93 0.492 . . . . 74.3 110.426 177.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 85.9 mt -57.21 -50.59 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.781 0.832 . . . . 64.13 110.52 171.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.617 HG23 ' HG2' ' A' ' 43' ' ' GLU . 19.5 mm -63.25 -42.85 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 115.668 -0.696 . . . . 72.04 111.305 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -63.53 -51.79 63.97 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 123.848 0.859 . . . . 63.01 110.471 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD11 ' HE2' ' A' ' 66' ' ' LYS . 82.4 mt -59.22 -53.0 63.28 Favored 'General case' 0 C--O 1.216 -0.699 0 O-C-N 124.04 0.838 . . . . 73.1 110.49 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.456 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -57.53 -38.62 88.26 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 124.64 1.212 . . . . 73.23 113.9 -177.009 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -74.4 -43.68 55.3 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 122.536 -0.39 . . . . 53.23 110.666 -179.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.84 -24.32 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.546 0.339 . . . . 64.14 110.353 175.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 35' ' ' VAL . 51.3 mt -64.43 -52.9 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.729 0.812 . . . . 62.02 108.913 171.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -54.34 -36.8 64.19 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 124.234 0.959 . . . . 73.42 111.25 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -72.04 -66.0 0.7 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.828 0.851 . . . . 75.14 111.34 178.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HD2' HG13 ' A' ' 76' ' ' ILE . 9.7 ptp180 -68.34 -19.31 64.64 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.732 0.813 . . . . 44.13 112.564 -170.586 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.9 t -64.59 -29.85 70.87 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.751 0.42 . . . . 71.53 110.874 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.44 -6.43 24.74 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.522 0.564 . . . . 71.24 112.522 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.81 -28.43 69.86 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 119.424 -0.322 . . . . 74.51 110.797 169.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' MET . . . . . 0.512 ' SD ' HD11 ' A' ' 85' ' ' ILE . 3.2 mmt -65.66 94.57 0.2 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.982 -0.748 . . . . 71.34 108.982 176.41 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -72.88 -26.69 61.53 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.816 0.817 . . . . 65.24 110.123 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' HD22 ' A' ' 151' ' ' LEU . 92.7 m-85 -93.88 -174.25 3.38 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.413 -1.721 . . . . 70.32 109.265 166.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 56.8 m 54.32 53.9 10.24 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.814 0.845 . . . . 71.21 112.8 174.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.0 -52.45 65.48 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.963 0.905 . . . . 73.33 112.14 -175.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 19.3 tptm -68.19 -47.83 66.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.279 -0.873 . . . . 75.15 110.993 -173.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 30' ' ' ARG . 19.1 mt-30 -73.02 -25.48 60.97 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.788 0.662 . . . . 75.0 112.788 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 t -71.19 -49.44 43.67 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.99 0.516 . . . . 65.53 110.271 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -73.35 -22.0 60.4 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.425 -0.807 . . . . 74.42 111.053 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.826 HH12 ' HB2' ' A' ' 98' ' ' PHE . 19.1 ttt-85 -63.12 -52.93 60.6 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.314 1.046 . . . . 75.54 110.043 169.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.87 -49.42 77.82 Favored 'General case' 0 C--N 1.359 1.011 0 O-C-N 123.843 0.714 . . . . 63.23 109.705 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.14 96.6 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 124.301 1.001 . . . . 51.32 112.895 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -63.12 -49.12 75.68 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.879 0.872 . . . . 72.0 111.019 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.487 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 84.1 mtt-85 -61.56 -56.37 20.72 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.053 0.846 . . . . 72.33 110.716 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.503 HG21 HG21 ' A' ' 14' ' ' ILE . 58.6 t -56.23 -46.44 81.38 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 O-C-N 124.296 0.997 . . . . 73.31 111.407 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 39' ' ' ILE . 72.3 mt -62.77 -40.98 98.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 123.443 0.465 . . . . 73.33 111.25 177.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.29 -27.56 71.78 Favored Glycine 0 CA--C 1.532 1.114 0 O-C-N 123.379 0.425 . . . . 75.42 112.951 177.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 47.9 mt -84.52 -47.75 10.28 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.305 0.642 . . . . 64.54 111.481 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 36' ' ' LEU . 22.4 pt -76.83 -40.28 31.64 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.357 0 CA-C-O 117.807 -1.092 . . . . 73.53 111.409 -171.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -54.39 -47.79 96.61 Favored Pre-proline 0 N--CA 1.493 1.675 0 N-CA-C 113.553 0.946 . . . . 75.15 113.553 -169.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.38 -48.01 23.81 Favored 'Trans proline' 0 C--N 1.401 3.315 0 C-N-CA 122.003 1.802 . . . . 53.54 111.395 171.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 4' ' ' LEU . 4.3 mm? -69.89 -25.23 63.6 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 124.087 0.867 . . . . 63.13 111.474 -177.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.617 ' HG2' HG23 ' A' ' 8' ' ' ILE . 43.4 mt-10 -67.22 -52.08 45.49 Favored 'General case' 0 C--N 1.354 0.783 0 N-CA-C 108.544 -0.91 . . . . 62.21 108.544 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 70.6 mtm -57.63 -45.85 84.9 Favored 'General case' 0 C--N 1.351 0.668 0 O-C-N 124.211 0.944 . . . . 54.44 110.306 177.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.9 mt -71.62 -21.57 61.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.732 0.813 . . . . 65.31 112.607 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.65 -53.11 7.95 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.581 0.753 . . . . 63.42 109.807 178.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -67.06 -38.89 86.62 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.681 0.613 . . . . 52.24 111.361 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -71.84 -32.79 67.87 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.112 0.565 . . . . 75.35 110.627 174.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -88.51 66.53 3.18 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.871 -0.492 . . . . 62.12 111.871 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -63.01 -35.93 81.86 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.721 0.808 . . . . 61.23 110.398 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.49 138.03 52.08 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.063 -0.717 . . . . 73.32 109.063 170.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.9 m -151.86 168.5 24.92 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.841 1.256 . . . . 70.23 108.56 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.5 t -105.54 98.32 16.88 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 108.86 -0.793 . . . . 54.22 108.86 171.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.623 ' HA ' HD23 ' A' ' 58' ' ' LEU . 6.1 Cg_exo -73.93 95.26 0.89 Allowed 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.218 1.946 . . . . 74.13 110.027 174.406 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -62.3 160.8 12.5 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.826 -0.625 . . . . 42.31 109.91 175.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -59.94 -50.7 72.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.967 0.507 . . . . 75.34 110.741 -175.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.84 67.13 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.637 -0.71 . . . . 53.32 112.051 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.623 HD23 ' HA ' ' A' ' 54' ' ' PRO . 33.4 tp -66.72 -48.89 67.77 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.903 0.481 . . . . 71.1 110.047 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.8 m -60.52 -43.36 97.18 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 124.189 0.931 . . . . 74.41 110.136 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -56.46 -47.65 78.71 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 123.793 0.683 . . . . 53.13 110.959 176.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.44 98.77 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.373 0.669 . . . . 72.44 111.439 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.47 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.1 mmt -64.71 -34.09 77.49 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.292 0.637 . . . . 75.43 111.266 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -73.72 -35.29 65.09 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.218 0.607 . . . . 70.41 110.653 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -66.06 -39.58 90.21 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.688 0.795 . . . . 65.4 110.27 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.586 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 3.3 t80 -70.76 -42.45 70.43 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.188 0.995 . . . . 73.21 110.234 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.434 ' HE2' HD11 ' A' ' 10' ' ' LEU . 14.7 tmtt? -64.72 -38.92 92.63 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.48 1.112 . . . . 75.2 110.053 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.8 -40.6 92.05 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.381 0.673 . . . . 72.02 111.009 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.67 80.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.385 0.674 . . . . 73.23 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -72.09 -26.09 62.01 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.786 -0.643 . . . . 75.1 111.067 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.72 -34.37 71.84 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.906 0.482 . . . . 72.14 110.351 172.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.505 ' HB3' HG22 ' A' ' 101' ' ' VAL . 25.3 mm-40 -64.13 -44.46 92.14 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.985 -0.552 . . . . 65.12 110.878 175.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -63.29 -59.72 4.34 Favored 'General case' 0 C--N 1.354 0.796 0 O-C-N 123.454 0.471 . . . . 53.13 110.555 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -47.64 -46.35 28.8 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.019 1.728 . . . . 73.43 111.875 -176.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.2 -44.05 87.59 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.471 1.107 . . . . 60.34 113.416 -176.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.479 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . 25.4 mt-10 -67.06 -48.36 68.49 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 118.294 -0.86 . . . . 72.43 111.028 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.605 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.8 pt -66.37 -26.77 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 CA-C-N 118.704 0.684 . . . . 73.14 111.678 176.519 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -60.77 -40.96 94.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.11 0.564 . . . . 72.04 110.232 171.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -85.39 -22.65 28.29 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.874 0.694 . . . . 74.24 112.874 175.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.605 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.2 m-85 -79.33 -1.63 37.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.549 0.74 . . . . 71.35 111.68 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.4 p -56.74 -26.33 56.91 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.424 0.689 . . . . 63.51 110.775 172.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -82.73 112.4 19.55 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 107.548 -1.278 . . . . 75.32 107.548 162.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.496 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.7 mpt_? -70.78 -23.69 62.44 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.069 0.548 . . . . 62.02 110.821 -175.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 25.5 m -63.73 -33.97 76.85 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.158 0.983 . . . . 61.01 111.66 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -57.09 -45.82 83.04 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.157 0.983 . . . . 51.43 110.075 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' A' ' 21' ' ' MET . 21.1 mt -60.79 -54.82 29.99 Favored 'Isoleucine or valine' 0 C--N 1.352 0.694 0 O-C-N 124.248 0.967 . . . . 75.34 109.869 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 27.5 t -57.18 -38.03 73.01 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.585 0.553 . . . . 74.31 111.678 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -63.18 -47.93 80.53 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 124.184 0.927 . . . . 74.53 111.243 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.95 -29.88 50.09 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 110.096 -0.335 . . . . 71.32 110.096 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 11.7 tp -69.04 -39.05 79.42 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.934 0.894 . . . . 71.03 110.254 -172.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -78.01 -27.59 48.97 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.346 0.659 . . . . 43.33 110.84 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.72 -55.39 4.86 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.519 0.728 . . . . 52.3 111.189 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.2 t -85.2 130.5 34.59 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 108.834 -0.802 . . . . 53.15 108.834 175.1 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -92.86 -11.94 32.28 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.504 0.722 . . . . 73.04 112.4 -170.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -146.73 4.46 0.87 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.32 0.859 . . . . 74.32 113.32 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -72.63 102.24 3.24 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 107.719 -1.215 . . . . 75.2 107.719 169.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.475 HG23 ' HB2' ' A' ' 141' ' ' ALA . 3.3 mm -58.23 146.77 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 106.531 -1.655 . . . . 75.43 106.531 168.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -39.9 -48.25 2.29 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.158 0.983 . . . . 71.53 111.925 -173.008 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.826 ' HB2' HH12 ' A' ' 30' ' ' ARG . 72.7 m-85 -128.42 47.44 2.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.06 0.944 . . . . 70.45 111.256 176.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.1 -62.13 1.85 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 124.418 1.087 . . . . 71.32 111.571 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.07 -42.55 96.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.174 -1.375 . . . . 71.15 110.76 -175.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 71' ' ' GLU . 61.3 t -63.21 -41.72 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 114.829 -1.078 . . . . 74.22 111.498 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -71.65 -32.94 68.47 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.351 0.66 . . . . 71.5 110.578 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -63.4 -41.38 98.75 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 108.904 -0.776 . . . . 73.13 108.904 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 60.3 mttm -63.37 -49.1 75.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.575 -0.739 . . . . 60.51 110.683 174.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.81 -42.21 97.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.938 0.895 . . . . 74.42 111.22 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.462 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 37.4 t -71.12 -47.79 55.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.054 0.846 . . . . 52.12 110.198 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.569 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 27.3 t70 -57.82 -57.2 13.81 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 124.051 0.844 . . . . 64.43 110.381 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.1 -38.59 82.85 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 CA-C-N 114.945 -1.025 . . . . 63.21 111.272 -178.037 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -60.46 -42.06 95.42 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.189 0.45 . . . . 74.11 111.221 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.569 ' HE2' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtmt -58.91 -57.0 15.01 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 109.665 -0.494 . . . . 73.52 109.665 174.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.66 -44.56 69.76 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.569 0.748 . . . . 74.45 111.784 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.47 HD11 ' SD ' ' A' ' 62' ' ' MET . 9.1 tt -70.21 -55.94 8.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.292 1.437 . . . . 53.32 109.885 -172.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.0 t -61.87 -31.64 71.92 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.836 0.855 . . . . 74.04 111.326 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 51.5 mt -70.24 -51.16 32.83 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 122.963 0.505 . . . . 71.23 111.031 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.87 -24.3 65.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.047 0.385 . . . . 74.43 110.497 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.651 HD22 ' SD ' ' A' ' 122' ' ' MET . 42.2 mt -64.53 -55.51 20.13 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 119.239 -0.41 . . . . 52.53 110.415 172.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -68.77 -32.8 72.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.438 0.533 . . . . 74.02 112.438 -174.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.9 -60.92 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.131 0.572 . . . . 73.11 110.802 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -84.21 -55.93 3.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.251 0.62 . . . . 72.31 111.748 -169.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 28.0 mp0 -82.86 -5.36 58.95 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 122.575 0.35 . . . . 70.43 111.723 -178.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 62.74 25.33 15.05 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.803 1.241 . . . . 73.41 112.344 172.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 116' ' ' LEU . 69.4 mtp -84.81 126.31 68.66 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.239 1.016 . . . . 63.03 109.998 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -80.0 59.12 7.3 Favored 'Trans proline' 0 C--N 1.374 1.915 0 C-N-CA 123.086 2.524 . . . . 61.12 113.44 -172.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.22 117.73 50.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.99 0.916 . . . . 72.43 109.814 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.5 t -165.94 52.76 0.27 Allowed Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.974 1.31 . . . . 73.31 108.551 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.25 -3.75 13.29 Favored 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 122.143 1.895 . . . . 74.21 112.605 -172.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 15.1 tt -122.89 131.12 73.86 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 C-N-CA 124.125 0.97 . . . . 70.44 108.549 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 26.8 t -87.27 86.48 7.27 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.702 -0.851 . . . . 71.25 108.702 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 75.09 -67.85 0.23 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.42 1.488 . . . . 74.2 112.677 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 112.3 25.01 4.86 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-O 120.196 -0.224 . . . . 54.14 113.353 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.37 -31.44 63.93 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.296 0.638 . . . . 74.24 110.508 176.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 33.7 m -65.61 -31.28 72.22 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.803 0.841 . . . . 61.44 111.159 173.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -18.38 64.92 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.451 1.1 . . . . 73.22 112.381 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.3 67.39 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.927 0.491 . . . . 45.24 110.669 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -69.27 -31.22 69.6 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.829 -0.623 . . . . 75.21 111.046 -177.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -55.72 -58.56 7.31 Favored 'General case' 0 C--O 1.211 -0.974 0 O-C-N 124.062 0.851 . . . . 62.44 110.407 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.63 -42.51 75.06 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.926 1.084 . . . . 75.4 113.926 -173.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.104 0.253 . . . . 75.44 110.857 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -70.96 -35.43 72.16 Favored 'General case' 0 C--N 1.359 1.0 0 O-C-N 123.099 0.249 . . . . 74.54 110.928 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -64.63 -56.42 13.94 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.986 -0.746 . . . . 40.13 108.986 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.475 ' HB2' HG23 ' A' ' 96' ' ' ILE . . . -58.11 -36.8 73.42 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 124.399 1.062 . . . . 34.34 111.95 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -56.93 -64.09 0.99 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 122.868 0.467 . . . . 64.34 110.155 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -63.69 -38.41 91.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.979 0.912 . . . . 75.43 111.922 -174.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 18.2 t0 -86.01 -45.19 11.68 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.385 -0.825 . . . . 73.51 111.942 -165.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.432 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 54.4 ttt-85 -65.45 -36.68 84.64 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.406 -0.59 . . . . 64.23 109.406 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 38.5 ttt180 -63.58 -44.45 94.02 Favored 'General case' 0 C--N 1.356 0.887 0 CA-C-N 116.013 -0.539 . . . . 72.22 110.514 173.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.609 ' HB1' ' HE ' ' A' ' 153' ' ' ARG . . . -72.36 -19.53 61.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.261 0.624 . . . . 63.33 112.576 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.482 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.7 OUTLIER -78.21 -60.47 2.36 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 109.138 -0.69 . . . . 63.23 109.138 176.29 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -70.39 -26.01 63.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.06 -0.973 . . . . 73.23 110.891 -173.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 41.9 ttp -117.31 56.85 0.81 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 107.388 -1.338 . . . . 73.13 107.388 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.406 HD22 ' CE1' ' A' ' 23' ' ' TYR . 59.9 tp -65.79 113.72 4.53 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.512 -0.767 . . . . 70.41 109.452 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -164.41 -76.24 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.347 -1.353 . . . . 72.24 107.347 -174.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ARG . . . . . 0.609 ' HE ' ' HB1' ' A' ' 147' ' ' ALA . 1.7 mpt_? 55.22 -85.8 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.301 1.04 . . . . 72.32 110.332 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -120.35 -43.45 2.51 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.081 -1.081 . . . . 75.44 108.081 170.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.3 t30 67.06 140.18 0.03 OUTLIER 'General case' 0 C--N 1.365 1.267 0 C-N-CA 125.682 1.593 . . . . 55.22 111.639 178.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 . . . . . 0 CA--C 1.551 1.015 0 N-CA-C 108.034 -1.098 . . . . 73.53 108.034 172.166 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 108.421 -0.955 . . . . 51.04 108.421 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -71.18 -43.27 67.79 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.715 -0.675 . . . . 74.04 110.339 -175.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -57.3 -51.16 70.51 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 109.432 -0.581 . . . . 73.32 109.432 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.523 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 4.3 mm? -56.37 -39.82 73.55 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.785 0.834 . . . . 61.43 111.247 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.52 -51.32 69.1 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.462 -0.94 . . . . 62.22 108.462 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -59.37 -52.75 64.27 Favored 'General case' 0 C--O 1.215 -0.725 0 O-C-N 123.788 0.68 . . . . 70.31 110.71 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.451 HG22 HD12 ' A' ' 8' ' ' ILE . 97.7 mt -52.92 -55.01 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.397 1.479 . . . . 62.0 112.365 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.451 HD12 HG22 ' A' ' 7' ' ' ILE . 1.7 mp -67.67 -36.88 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 124.046 0.938 . . . . 72.02 110.959 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.6 m -65.75 -46.03 80.36 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.343 0.657 . . . . 62.43 110.411 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.79 -44.44 86.27 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 123.72 0.808 . . . . 61.22 109.736 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.463 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -60.29 -53.4 45.94 Favored Glycine 0 C--N 1.347 1.164 0 O-C-N 124.251 0.969 . . . . 73.03 113.052 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.466 ' HG3' HD12 ' A' ' 39' ' ' ILE . 33.5 mt-30 -66.41 -31.95 73.03 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 112.033 0.383 . . . . 74.1 112.033 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -70.36 -36.92 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.331 0.653 . . . . 70.32 110.723 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.413 HG21 HG21 ' A' ' 35' ' ' VAL . 37.3 mt -58.77 -49.24 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.641 0.776 . . . . 72.24 109.056 175.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -56.47 -52.9 62.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.695 -1.139 . . . . 71.53 111.343 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -60.7 -57.61 11.95 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 123.799 0.687 . . . . 73.11 111.053 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -73.58 -17.19 61.21 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 112.683 0.623 . . . . 75.12 112.683 -173.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 45.7 t -60.41 -17.11 41.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.147 0.579 . . . . 71.21 111.578 170.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -55.13 -23.38 20.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.514 0.726 . . . . 74.45 112.175 172.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -66.02 -15.6 63.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.456 0.702 . . . . 64.13 112.036 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.0 mmt -78.14 82.69 4.46 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.858 -0.793 . . . . 71.41 108.858 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -35.45 73.9 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.781 -1.192 . . . . 65.42 107.781 173.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.423 ' HE2' HD22 ' A' ' 151' ' ' LEU . 70.7 m-85 -97.03 177.16 5.7 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.656 -1.156 . . . . 61.42 109.569 165.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 70.9 m 54.53 58.11 5.18 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.772 0.796 . . . . 74.15 109.835 -173.175 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -70.1 -49.83 46.9 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-N 114.255 -1.339 . . . . 75.4 110.872 -169.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 24.0 mmtp -61.1 -46.61 89.91 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 108.495 -0.928 . . . . 73.3 108.495 177.27 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -57.66 -36.09 71.43 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.343 1.027 . . . . 72.22 113.441 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 40.7 t -70.9 -42.32 70.1 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.405 0.44 . . . . 74.23 110.667 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -71.71 -28.3 63.6 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 115.71 -0.677 . . . . 73.32 110.945 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.698 ' HD2' ' HB3' ' A' ' 136' ' ' GLU . 33.7 ttp180 -82.6 -38.05 24.15 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.489 1.116 . . . . 73.44 109.788 -173.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.2 tp -65.75 -43.39 89.08 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.178 -1.045 . . . . 74.24 108.178 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.93 -35.36 90.37 Favored Glycine 0 C--N 1.351 1.398 0 O-C-N 123.753 0.658 . . . . 34.23 112.745 173.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -64.78 -51.52 61.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.344 0.658 . . . . 74.53 110.742 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.1 mtt-85 -57.6 -59.49 5.11 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.609 -1.178 . . . . 74.11 110.155 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.413 HG21 HG21 ' A' ' 14' ' ' ILE . 54.6 t -58.86 -52.38 61.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 124.668 1.23 . . . . 73.35 112.05 -174.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.28 -45.87 82.69 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 118.046 0.384 . . . . 63.34 110.349 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.41 -24.49 65.79 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 123.258 0.349 . . . . 53.11 113.494 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.458 ' O ' HD23 ' A' ' 42' ' ' LEU . 11.4 tp -86.84 -40.15 15.18 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.577 1.151 . . . . 52.44 112.071 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.466 HD12 ' HG3' ' A' ' 12' ' ' GLN . 15.6 pt -84.6 -33.76 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-O 119.275 -0.393 . . . . 74.03 111.792 -171.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -54.3 -53.76 55.6 Favored Pre-proline 0 N--CA 1.49 1.542 0 CA-C-O 117.992 -1.004 . . . . 71.21 113.131 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.773 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 20.8 Cg_endo -57.68 -38.66 92.5 Favored 'Trans proline' 0 C--N 1.396 3.053 0 C-N-CA 122.218 1.945 . . . . 43.22 112.243 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.5 mm? -66.64 -36.34 82.34 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.609 -0.723 . . . . 71.24 111.296 178.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -73.53 -29.42 62.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.913 0.885 . . . . 71.41 111.666 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.7 mmt -64.9 -33.39 75.91 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.828 0.451 . . . . 61.1 111.336 178.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.38 -41.5 14.43 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.572 0.349 . . . . 73.33 111.773 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -58.86 -45.82 89.21 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.543 0.737 . . . . 75.42 111.95 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -87.05 -20.75 26.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.435 0.694 . . . . 72.12 111.167 -171.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -102.58 -59.87 1.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.086 -0.506 . . . . 72.13 110.385 -172.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.89 85.28 0.39 Allowed Glycine 0 C--N 1.343 0.951 0 CA-C-N 115.79 -0.641 . . . . 42.31 111.598 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.06 95.66 0.17 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 109.518 -0.549 . . . . 74.24 109.518 178.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.413 ' O ' ' HE2' ' A' ' 1' ' ' MET . 22.3 mmt180 -68.77 90.24 0.41 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.864 0.866 . . . . 63.11 110.586 -178.358 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 21.3 m -71.85 -7.29 47.52 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.348 -1.296 . . . . 71.14 112.446 -175.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.3 t -113.06 90.19 15.47 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 108.432 -0.951 . . . . 63.44 108.432 169.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HA ' HD23 ' A' ' 58' ' ' LEU . 96.0 Cg_endo -89.34 112.51 0.56 Allowed 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.423 2.082 . . . . 64.15 111.113 173.557 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.2 p -62.44 156.45 22.69 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.953 0.501 . . . . 71.34 110.197 176.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -54.21 -51.78 63.34 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.634 0.774 . . . . 74.35 110.85 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -55.85 -38.73 70.45 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.932 0.893 . . . . 70.32 112.351 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 62' ' ' MET . 62.0 tp -67.65 -51.89 44.56 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 124.059 0.944 . . . . 73.12 109.275 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.3 m -61.64 -36.69 81.51 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.281 1.032 . . . . 55.53 111.521 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.8 m -66.67 -47.78 71.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.334 0.654 . . . . 71.11 109.382 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 65' ' ' PHE . . . -56.43 -41.29 76.15 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.722 -0.672 . . . . 75.34 110.178 175.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' LEU . 25.1 mmt -67.25 -28.45 68.05 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.987 0.915 . . . . 70.14 111.934 177.504 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -70.29 -49.08 53.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.84 0.456 . . . . 54.22 110.767 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -68.19 -33.77 75.06 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 120.529 0.204 . . . . 74.41 110.562 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 1.8 t80 -61.1 -56.25 23.03 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.945 1.298 . . . . 75.11 109.674 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 48.8 tttm -55.77 -50.06 71.46 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.224 -1.353 . . . . 74.15 110.695 175.437 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.47 -49.86 69.08 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.104 0.961 . . . . 63.1 112.15 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.34 -28.85 64.37 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.412 0.685 . . . . 62.33 111.722 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.4 mt -75.64 -28.18 58.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.718 0.407 . . . . 74.32 111.696 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 51.4 mt-10 -69.92 -42.69 72.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 109.445 -0.576 . . . . 63.34 109.445 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 42.4 mt-10 -63.66 -45.38 90.42 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.979 -1.009 . . . . 72.32 110.354 176.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.6 98.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.278 0.631 . . . . 71.34 111.39 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -57.8 -44.8 86.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.763 1.225 . . . . 64.45 110.265 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -68.23 -32.98 77.03 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 114.764 -1.107 . . . . 44.41 113.209 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 48.7 mm-40 -68.0 -51.06 51.53 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 116.915 0.357 . . . . 72.22 110.866 -179.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.557 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -66.44 -28.79 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 118.269 0.486 . . . . 74.42 112.284 175.541 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -60.74 -41.71 95.93 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.867 -0.79 . . . . 52.05 108.867 172.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -69.25 -39.61 78.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.842 1.257 . . . . 54.31 111.008 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.473 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 18.4 m-85 -81.46 5.45 17.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.996 0.918 . . . . 74.51 112.443 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.9 p -56.7 -32.56 65.59 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.214 0.53 . . . . 65.41 110.199 171.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -86.99 117.56 25.79 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.922 -1.036 . . . . 70.23 109.209 168.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.576 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.4 mpt_? -78.87 -26.17 43.94 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.229 1.012 . . . . 64.13 109.803 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -61.26 -38.65 87.45 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.92 0.888 . . . . 65.14 110.601 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.64 -44.26 96.59 Favored 'General case' 0 C--O 1.257 1.45 0 C-N-CA 124.265 1.026 . . . . 75.42 110.595 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.449 HG12 ' CD1' ' A' ' 79' ' ' PHE . 19.6 mt -60.93 -54.86 29.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 CA-C-N 115.091 -0.958 . . . . 62.42 109.611 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.8 t -54.66 -43.05 72.06 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.556 0.743 . . . . 63.51 111.235 -177.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 49.3 ttm-85 -56.67 -54.98 39.83 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.508 1.13 . . . . 74.12 111.362 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.479 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.18 -26.32 56.07 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.508 -0.314 . . . . 74.21 110.541 -176.805 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp -71.24 -43.72 66.73 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.077 0.951 . . . . 71.22 110.701 -170.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.6 t -65.08 -19.81 66.17 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.074 -0.966 . . . . 73.14 110.805 177.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.55 -26.97 14.24 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.312 1.045 . . . . 71.44 112.175 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 90.9 p -74.38 118.18 17.04 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.774 0.429 . . . . 62.33 110.255 -172.174 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -68.89 -30.61 69.14 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.31 0.644 . . . . 71.21 110.341 -178.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.465 ' HB3' ' HD3' ' A' ' 99' ' ' LYS . 4.9 m-20 -65.12 -41.48 94.82 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.317 -1.31 . . . . 75.3 109.917 176.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.584 ' HD2' ' HD2' ' A' ' 145' ' ' ARG . 6.2 mtmp? 67.06 12.47 8.99 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.843 1.257 . . . . 74.05 111.066 -175.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 12.9 mt -125.42 119.87 56.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.984 -1.117 . . . . 63.22 107.984 -178.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.479 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 7.1 mp -53.26 -39.22 63.69 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.699 1.599 . . . . 73.11 112.2 175.145 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 81.6 m-85 -122.87 35.07 4.96 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.331 0.653 . . . . 72.11 111.16 -173.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.669 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 38.3 tttm -63.3 -52.42 62.01 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.066 0.848 . . . . 63.43 110.45 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -75.02 -37.63 61.72 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.653 -0.703 . . . . 61.11 110.737 -175.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.69 -39.08 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 122.598 0.359 . . . . 75.34 110.814 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.4 -25.33 50.72 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.082 0.553 . . . . 64.32 110.767 176.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.71 -43.93 97.9 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.63 -0.507 . . . . 64.44 109.63 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -58.68 7.41 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.375 -0.602 . . . . 75.32 109.375 171.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.4 mt -54.42 -32.55 57.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.823 0.849 . . . . 62.24 112.466 -177.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.9 t -78.36 -47.1 18.39 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.631 0.772 . . . . 71.23 111.237 -176.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.652 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 22.5 t70 -69.34 -41.36 76.75 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 121.427 0.632 . . . . 53.22 110.436 -177.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.18 -48.54 86.52 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 CA-C-N 114.792 -1.095 . . . . 74.45 109.706 171.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.602 ' HE3' HD23 ' A' ' 112' ' ' LEU . 10.6 t-105 -63.15 -25.62 68.43 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.333 0.653 . . . . 72.45 112.119 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.6 mtpt -63.66 -63.05 1.28 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.701 -0.851 . . . . 74.24 108.701 171.83 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.33 -47.23 72.75 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.91 0.862 . . . . 73.31 110.679 -177.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 109' ' ' TRP . 47.5 tp -60.11 -56.25 23.89 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 112.902 -1.954 . . . . 61.12 110.529 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.428 ' HB2' HG11 ' A' ' 124' ' ' VAL . 91.3 p -61.25 -33.86 74.21 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.562 0.345 . . . . 72.52 111.843 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.3 mt -63.33 -54.86 30.32 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 123.814 0.696 . . . . 72.12 110.134 176.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 pp -69.38 -23.7 63.77 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 111.84 0.311 . . . . 75.32 111.84 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.443 HD13 ' SD ' ' A' ' 122' ' ' MET . 85.8 mt -70.78 -45.03 65.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.891 0.476 . . . . 55.23 111.28 174.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -79.29 -31.11 43.23 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 122.111 -0.368 . . . . 75.31 111.6 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 76.3 t -83.47 -48.64 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 C-N-CA 122.7 0.4 . . . . 64.11 110.965 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -90.85 -57.94 2.64 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.272 0.558 . . . . 64.52 111.22 -176.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -83.03 -0.76 50.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.577 -0.738 . . . . 73.42 111.644 -170.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 62.26 24.16 14.35 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.156 1.382 . . . . 63.31 113.44 171.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.773 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 49.1 ttm -78.06 131.66 69.15 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 123.936 0.894 . . . . 72.42 110.396 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.25 96.97 1.12 Allowed 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.127 1.885 . . . . 62.23 111.799 179.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 113' ' ' SER . 28.0 t -126.73 143.77 39.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.404 0.682 . . . . 74.33 109.382 177.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 47.5 t -163.55 -63.67 0.01 OUTLIER Pre-proline 0 CA--C 1.57 1.718 0 N-CA-C 112.857 0.688 . . . . 72.34 112.857 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.81 -14.56 26.84 Favored 'Trans proline' 0 C--N 1.392 2.832 0 C-N-CA 122.259 1.973 . . . . 71.14 114.073 -164.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.6 tt -110.53 -16.36 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.222 1.009 . . . . 75.31 111.236 -171.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 19.6 m -64.93 -47.89 76.09 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.591 0.756 . . . . 73.31 110.613 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -58.43 -30.11 66.65 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.454 -1.248 . . . . 70.2 112.051 176.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 62.28 26.27 67.63 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.743 0.652 . . . . 74.02 113.702 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.93 -44.53 80.43 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 75.44 110.476 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 90.6 p -63.77 -50.85 67.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.401 -0.818 . . . . 72.23 109.842 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -52.19 -38.33 57.47 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.338 1.455 . . . . 75.01 113.364 -176.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.63 -55.28 16.01 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.155 0.582 . . . . 62.52 110.281 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -29.41 70.61 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.186 -0.915 . . . . 73.02 111.7 -177.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.698 ' HB3' ' HD2' ' A' ' 30' ' ' ARG . 34.9 mt-10 -57.04 -60.46 3.56 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.706 1.202 . . . . 73.42 110.787 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.608 ' HB3' HD13 ' A' ' 96' ' ' ILE . 32.5 m-20 -56.36 -39.8 73.48 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 116.293 -0.412 . . . . 74.22 111.431 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.23 -64.45 0.86 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 123.141 0.276 . . . . 73.52 111.043 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -62.36 -50.54 71.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.571 0.701 . . . . 53.54 110.674 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 3.1 m-20 -75.48 -40.54 57.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.234 -1.348 . . . . 73.44 112.135 -167.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ALA . . . . . 0.523 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.36 -22.39 59.24 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 118.923 0.783 . . . . 60.34 111.269 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 35.7 t70 -70.98 -34.5 71.46 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 109.76 -0.459 . . . . 72.52 109.76 169.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -68.62 -35.46 77.34 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.203 0.601 . . . . 63.45 111.199 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.38 -36.45 68.73 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.156 0.582 . . . . 73.35 110.467 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' ARG . . . . . 0.584 ' HD2' ' HD2' ' A' ' 95' ' ' LYS . 45.1 ttt180 -58.37 -45.56 88.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.657 -1.156 . . . . 71.53 109.958 171.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 48.5 mtt180 -66.99 -39.9 87.24 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.321 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.439 ' O ' HD13 ' A' ' 151' ' ' LEU . . . -71.16 -23.01 61.98 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.287 0.635 . . . . 72.14 111.617 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 148' ' ' PHE . . . . . 0.454 ' HB3' HE21 ' A' ' 149' ' ' GLN . 0.1 OUTLIER -86.95 -60.5 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.415 0.626 . . . . 64.3 111.251 175.452 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 149' ' ' GLN . . . . . 0.454 HE21 ' HB3' ' A' ' 148' ' ' PHE . 33.1 mm-40 -82.69 -27.09 31.48 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.904 -1.044 . . . . 74.33 112.654 -165.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.1 ttm -100.04 -70.88 0.72 Allowed 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.788 -0.819 . . . . 72.25 108.788 173.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 147' ' ' ALA . 16.6 tp 63.1 162.73 0.1 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.221 1.409 . . . . 64.03 111.818 -179.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -151.72 70.82 0.96 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.338 -0.986 . . . . 72.22 108.338 174.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -171.16 -59.88 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.796 1.238 . . . . 64.33 107.926 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ASP . . . . . 0.428 ' O ' HD23 ' A' ' 151' ' ' LEU . 26.8 t70 -126.4 163.71 22.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.233 1.013 . . . . 71.23 109.34 -175.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -164.27 162.06 22.27 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.44 0.696 . . . . 54.21 110.031 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? . . . . . 0 CA--C 1.557 1.229 0 CA-C-O 118.646 -0.692 . . . . 74.2 111.331 177.872 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 120.926 0.393 . . . . 72.51 110.146 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -68.04 -52.21 37.98 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.333 1.053 . . . . 64.3 110.109 -170.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -71.02 -29.28 65.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.692 -1.14 . . . . 74.52 110.842 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.473 HD21 HD12 ' A' ' 42' ' ' LEU . 0.9 OUTLIER -73.59 -40.17 64.08 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.162 -0.681 . . . . 74.15 109.162 -179.196 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' O ' ' HD3' ' A' ' 5' ' ' LYS . 6.8 tmtt? -71.38 -30.98 66.77 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.305 -0.998 . . . . 75.23 108.305 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.498 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 57.5 t-80 -64.61 -40.61 95.8 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 119.304 -0.379 . . . . 65.43 110.14 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 93.6 mt -56.83 -46.14 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 C-N-CA 124.262 1.025 . . . . 74.54 110.526 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.481 HD12 ' HG2' ' A' ' 43' ' ' GLU . 34.1 mm -54.54 -54.15 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 115.16 -0.927 . . . . 51.24 110.547 174.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.2 m -57.52 -40.1 78.03 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 124.409 1.084 . . . . 73.42 111.252 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 93.4 mt -61.18 -57.9 10.53 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 123.923 0.764 . . . . 75.3 109.99 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.612 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.18 -36.04 73.17 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 124.65 1.219 . . . . 74.4 113.583 -176.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -62.8 -54.39 39.69 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.876 0.47 . . . . 63.5 110.904 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.62 -31.19 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.73 0.812 . . . . 61.45 111.269 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.549 HG23 HD11 ' A' ' 76' ' ' ILE . 36.5 mt -61.96 -60.12 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.612 1.165 . . . . 73.32 109.261 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -66.27 -27.83 68.24 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 123.249 0.343 . . . . 64.14 111.002 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -63.46 -48.41 77.82 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.712 . . . . 73.23 110.55 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -83.93 -16.2 45.1 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.001 0.521 . . . . 54.33 111.888 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.6 t -66.27 -21.58 66.29 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.056 0.543 . . . . 72.54 110.354 172.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.78 -21.59 66.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.6 0.76 . . . . 65.52 111.855 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -68.33 -14.15 62.79 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.205 0.602 . . . . 74.54 112.47 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.4 mmt -77.07 85.34 3.57 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.088 0.47 . . . . 65.52 110.352 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -40.79 76.55 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.673 -0.862 . . . . 72.42 108.673 167.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -106.81 164.82 11.79 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.484 -1.235 . . . . 72.35 109.216 170.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.625 ' SG ' HG21 ' A' ' 85' ' ' ILE . 29.3 m 58.93 53.26 5.78 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 124.342 1.026 . . . . 64.52 110.023 -167.048 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -73.84 -42.16 61.24 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.008 -1.451 . . . . 74.33 111.765 -170.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.482 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 22.5 tptp -74.33 -45.02 49.95 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.208 -0.905 . . . . 71.23 109.867 -170.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -76.23 -22.22 55.46 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 116.026 -0.534 . . . . 70.3 111.24 176.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 t -61.57 -50.92 70.7 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.756 -0.461 . . . . 53.53 109.756 169.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -62.07 -38.7 89.82 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.181 0.925 . . . . 75.4 111.288 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HB3' HH21 ' A' ' 34' ' ' ARG . 4.1 mmp_? -51.06 -61.72 2.06 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.383 0.427 . . . . 64.31 110.01 172.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.62 -46.44 80.93 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.522 1.139 . . . . 71.31 110.887 -175.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.31 -49.89 58.94 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.967 0.792 . . . . 52.2 113.179 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -59.36 -38.13 79.63 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.536 0.735 . . . . 61.35 111.261 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.564 HH21 ' HB3' ' A' ' 30' ' ' ARG . 14.5 mtt180 -60.44 -59.42 5.44 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 123.721 0.638 . . . . 71.23 110.477 175.59 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.527 HG21 HG21 ' A' ' 14' ' ' ILE . 53.6 t -57.68 -41.07 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 124.516 1.135 . . . . 61.3 111.467 -174.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.17 -43.23 98.86 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.704 0.628 . . . . 70.33 110.053 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.88 -22.55 72.16 Favored Glycine 0 CA--C 1.537 1.43 0 O-C-N 123.448 0.468 . . . . 72.13 113.442 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 39.4 mt -84.35 -44.78 13.44 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 122.833 0.453 . . . . 53.24 110.983 178.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' HA3' ' A' ' 11' ' ' GLY . 13.3 pt -85.17 -25.06 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-O 118.964 -0.541 . . . . 65.24 111.989 -172.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -54.41 -56.01 31.24 Favored Pre-proline 0 CA--C 1.571 1.787 0 C-N-CA 123.598 0.759 . . . . 72.23 112.336 -176.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 87.9 Cg_endo -72.28 -33.82 8.65 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.025 1.817 . . . . 62.52 111.944 -175.208 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.473 HD12 HD21 ' A' ' 4' ' ' LEU . 4.4 mm? -65.37 -39.5 92.38 Favored 'General case' 0 C--N 1.352 0.685 0 O-C-N 123.934 0.771 . . . . 75.01 109.497 176.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' HD12 ' A' ' 8' ' ' ILE . 3.7 mm-40 -64.4 -39.92 94.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.107 0.963 . . . . 64.44 111.443 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 31.9 mmt -60.36 -53.52 56.59 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 123.658 0.599 . . . . 71.03 110.549 177.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.6 mt -71.5 -26.6 62.74 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.565 0.746 . . . . 63.41 112.187 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -46.42 26.36 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.964 0.906 . . . . 73.52 109.464 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.02 -34.58 78.78 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.256 0.623 . . . . 72.22 110.771 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -65.55 -45.84 81.82 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.723 -0.671 . . . . 62.41 109.647 170.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.58 46.79 23.71 Favored Glycine 0 C--N 1.343 0.943 0 CA-C-N 115.731 -0.668 . . . . 53.34 111.792 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -78.42 132.92 37.52 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.149 0.579 . . . . 62.41 110.205 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 92.1 mtt180 -65.18 96.36 0.21 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.627 0.771 . . . . 74.24 110.786 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.419 ' HB3' ' NE2' ' A' ' 120' ' ' GLN . 49.9 m -92.01 163.18 14.08 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.973 -1.012 . . . . 74.03 110.174 177.414 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.16 109.39 58.39 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.357 0.663 . . . . 55.05 109.375 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_exo -73.11 174.74 11.53 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 122.71 2.273 . . . . 55.12 112.487 172.301 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 45.2 t -153.53 165.13 36.84 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.706 1.203 . . . . 64.4 108.091 178.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.45 -44.83 81.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.749 0.42 . . . . 73.54 110.276 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -70.95 -29.16 65.09 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.835 0.854 . . . . 54.12 111.166 176.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.606 ' HB2' ' HB3' ' A' ' 55' ' ' SER . 1.7 tm? -62.17 -48.66 79.07 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 107.825 -1.176 . . . . 72.13 107.825 176.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -64.88 -41.31 95.73 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.94 -1.027 . . . . 71.22 110.587 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.8 m -60.77 -44.66 96.48 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.696 0.623 . . . . 73.41 110.668 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.95 97.53 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.769 0.827 . . . . 52.44 110.102 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.97 -26.11 64.88 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.322 0.649 . . . . 72.42 111.564 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -75.65 -39.49 57.61 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.198 0.599 . . . . 73.51 110.393 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -72.13 -33.29 67.67 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.53 0.732 . . . . 64.21 110.335 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.71 -48.01 64.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.293 1.037 . . . . 74.11 108.785 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -55.47 -53.29 58.12 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 124.592 1.157 . . . . 41.41 110.591 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.67 94.09 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.559 0.743 . . . . 75.02 111.531 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.452 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.65 -36.12 81.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.506 0.722 . . . . 62.23 111.38 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 mt -71.36 -33.59 69.71 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.875 0.47 . . . . 72.23 111.057 177.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -67.05 -34.89 78.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.681 0.392 . . . . 71.43 110.174 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 46.8 mt-10 -64.55 -44.12 91.78 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.626 -0.715 . . . . 74.11 110.741 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.91 -46.73 89.48 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 123.545 0.528 . . . . 74.1 110.646 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -56.87 -44.03 81.84 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.152 1.381 . . . . 74.33 110.22 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.01 -40.43 97.11 Favored Glycine 0 C--N 1.35 1.341 0 O-C-N 124.058 0.849 . . . . 73.51 113.322 178.598 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 8.4 mm-40 -59.9 -60.29 4.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.946 0.498 . . . . 74.25 110.509 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.554 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.4 pt -66.97 -20.31 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 112.586 0.588 . . . . 74.1 112.586 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -63.4 -48.74 76.58 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.819 -0.808 . . . . 71.44 108.819 171.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.0 ttmt -76.18 -25.38 55.16 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.693 -0.685 . . . . 75.11 111.224 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-30 -75.35 -4.38 38.98 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.513 0.725 . . . . 33.4 112.549 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.4 p -57.43 -25.54 59.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.983 0.513 . . . . 65.52 111.42 173.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -90.98 111.93 23.59 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 107.986 -1.116 . . . . 71.12 107.986 169.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -76.56 -29.74 56.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.657 0.783 . . . . 70.34 110.911 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.7 p -69.9 -31.65 69.55 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.035 0.534 . . . . 71.34 110.642 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -62.89 -44.44 96.09 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 123.601 0.76 . . . . 71.21 110.172 174.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.625 HG21 ' SG ' ' A' ' 24' ' ' CYS . 34.5 mt -57.17 -55.06 22.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.155 0 O-C-N 124.337 1.023 . . . . 63.02 108.918 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 36.5 t -53.73 -39.94 65.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 124.2 0.938 . . . . 74.22 111.866 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -63.41 -43.77 96.54 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 123.918 0.761 . . . . 71.13 111.585 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -28.35 45.84 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 110.17 -0.307 . . . . 71.51 110.17 177.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.04 -26.5 43.14 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.454 1.102 . . . . 64.11 111.061 -167.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.1 t -76.92 -28.16 55.18 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.882 -0.599 . . . . 74.41 110.412 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.01 -44.69 29.95 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.554 0.742 . . . . 64.01 110.651 178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.0 p -89.55 116.1 27.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.659 0.784 . . . . 73.11 109.007 177.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -96.1 -49.88 5.07 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.122 0.419 . . . . 73.23 111.563 -175.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -97.46 -43.26 7.34 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.633 -0.506 . . . . 72.14 109.633 -176.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.421 ' HE2' ' HB3' ' A' ' 99' ' ' LYS . 13.7 tmtt? -48.22 107.6 0.13 Allowed 'General case' 0 C--N 1.36 1.04 0 O-C-N 125.632 1.832 . . . . 63.34 110.325 -175.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 137' ' ' ASP . 2.5 mp -58.0 147.78 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 124.112 0.965 . . . . 63.13 109.248 -177.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.4 tp -47.53 -42.27 22.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.284 1.033 . . . . 63.42 111.331 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PHE . . . . . 0.554 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 32.7 m-85 -120.73 32.27 6.06 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 114.697 -1.138 . . . . 64.22 111.181 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.421 ' HB3' ' HE2' ' A' ' 95' ' ' LYS . 60.1 tttp -48.54 -63.22 1.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.905 0.882 . . . . 74.54 112.792 -175.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.87 -48.91 67.34 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.896 0.879 . . . . 52.24 111.12 -174.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.62 -40.01 85.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 114.713 -1.13 . . . . 62.41 110.981 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -76.95 -28.85 55.36 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.1 0.56 . . . . 64.54 110.74 -176.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -61.88 -40.83 96.76 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 109.045 -0.724 . . . . 74.32 109.045 172.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.64 -48.64 71.5 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 123.762 0.663 . . . . 70.0 111.191 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.452 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -55.3 -47.05 76.16 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.277 0.631 . . . . 64.35 110.534 177.317 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 33.6 t -65.26 -49.89 67.86 Favored 'General case' 0 C--O 1.212 -0.917 0 O-C-N 124.347 1.03 . . . . 74.22 110.599 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -56.34 -56.38 21.79 Favored 'General case' 0 C--O 1.261 1.669 0 O-C-N 124.224 0.953 . . . . 72.45 110.734 -176.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 47.8 t -62.33 -42.04 93.95 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.185 0 CA-C-N 113.926 -1.488 . . . . 70.15 110.136 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TRP . . . . . 0.716 ' HH2' HG12 ' A' ' 124' ' ' VAL . 20.1 t-105 -62.94 -43.46 98.74 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.734 0.646 . . . . 74.12 112.289 -179.444 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 106' ' ' SER . 47.7 mtmt -59.52 -56.35 23.09 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.783 -0.451 . . . . 74.12 109.783 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.57 -21.76 61.83 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.881 -0.6 . . . . 65.21 111.862 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 3.3 tp -66.35 -60.0 3.17 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 107.158 -1.423 . . . . 64.53 107.158 176.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.8 t -52.72 -41.74 64.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 114.428 -1.26 . . . . 52.21 111.018 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 89.8 mt -58.6 -60.39 3.89 Favored 'General case' 0 C--N 1.361 1.076 0 O-C-N 124.149 0.906 . . . . 65.1 111.346 177.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.31 -27.76 69.25 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 120.698 0.285 . . . . 75.43 111.741 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.575 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 83.1 mt -67.13 -56.56 9.44 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 123.205 0.602 . . . . 74.55 110.389 177.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.71 -31.34 66.63 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.357 0.502 . . . . 63.42 112.357 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 88.1 t -77.13 -57.36 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.438 0.461 . . . . 73.4 110.261 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -97.04 -57.32 2.3 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.099 0.56 . . . . 74.32 111.16 -168.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.419 ' NE2' ' HB3' ' A' ' 52' ' ' SER . 0.0 OUTLIER -74.67 -1.49 22.0 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.267 0.627 . . . . 62.12 111.37 -175.526 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 65.62 12.42 8.22 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.632 1.573 . . . . 72.45 112.182 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' MET . . . . . 0.575 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 66.8 mtp -87.01 110.96 37.18 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.176 0.99 . . . . 72.34 110.691 -173.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -82.43 65.79 8.22 Favored 'Trans proline' 0 C--N 1.372 1.78 0 C-N-CA 123.19 2.593 . . . . 64.42 111.4 -177.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' VAL . . . . . 0.716 HG12 ' HH2' ' A' ' 109' ' ' TRP . 37.9 t -95.77 89.33 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.251 -0.886 . . . . 75.44 110.595 -169.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 66.0 m -148.03 73.07 11.24 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.878 0.871 . . . . 72.1 109.281 175.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.44 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 10.0 Cg_endo -98.11 14.58 0.69 Allowed 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.326 2.684 . . . . 71.51 113.897 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.625 HG23 ' H ' ' A' ' 128' ' ' SER . 8.6 tt -141.4 -84.02 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-O 119.076 -0.488 . . . . 71.03 109.816 -174.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' SER . . . . . 0.625 ' H ' HG23 ' A' ' 127' ' ' ILE . 68.9 m -159.35 -81.04 0.05 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.775 -1.195 . . . . 61.42 107.775 173.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLN . . . . . 0.443 ' HG2' ' HG2' ' A' ' 110' ' ' LYS . 26.4 tt0 179.59 -34.05 0.01 OUTLIER 'General case' 0 C--N 1.363 1.162 0 C-N-CA 124.239 1.016 . . . . 73.3 110.135 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.9 -9.21 8.57 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.57 -0.572 . . . . 72.51 114.089 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.41 90.99 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.408 0.683 . . . . 74.32 111.113 176.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 14.6 m -56.85 -36.29 69.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.593 1.157 . . . . 73.43 111.454 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' TRP . . . . . 0.424 ' HA ' ' HB2' ' A' ' 136' ' ' GLU . 47.4 m0 -63.12 -27.89 69.69 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.138 0.975 . . . . 75.44 112.187 -174.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.9 74.51 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 122.782 0.433 . . . . 63.22 111.544 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -89.73 -39.69 12.99 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.644 0.778 . . . . 72.12 111.135 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 133' ' ' TRP . 20.5 mm-40 -65.92 -64.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.076 0.55 . . . . 62.02 110.878 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.44 ' HB3' HG21 ' A' ' 96' ' ' ILE . 3.7 m-20 -48.14 -36.56 13.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.554 1.142 . . . . 71.43 112.324 178.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -66.83 -58.7 4.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.73 0.812 . . . . 75.1 111.269 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.89 -39.05 87.8 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.445 0.641 . . . . 73.13 110.754 -177.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -65.81 -39.29 90.75 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 114.479 -1.237 . . . . 75.2 110.229 176.942 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.03 -48.9 79.81 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.648 0.379 . . . . 74.25 111.03 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.04 -54.05 51.33 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 124.248 0.967 . . . . 72.34 111.298 177.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -76.6 -21.96 54.86 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.33 0.863 . . . . 74.41 113.33 -172.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.482 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 32.4 t0 -86.71 -34.55 19.66 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.917 -0.401 . . . . 64.55 109.917 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -65.95 -38.19 87.95 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.043 -0.526 . . . . 72.43 109.985 168.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -64.3 -41.83 96.66 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.37 -0.832 . . . . 71.31 109.576 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.28 -27.57 60.8 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.502 0.721 . . . . 74.43 111.931 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.18 -58.29 3.36 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.461 -0.57 . . . . 64.01 109.461 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -67.59 -44.3 78.45 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.655 -1.157 . . . . 74.14 111.255 -172.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 46.6 ttm -83.7 -79.3 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.33 -0.618 . . . . 72.15 109.33 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 61.0 tp 56.21 -74.81 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.457 1.103 . . . . 75.4 111.202 -172.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? 88.58 -25.84 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.554 1.942 . . . . 73.42 110.138 165.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -48.27 -60.28 2.78 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.393 1.477 . . . . 71.21 111.681 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -172.23 94.21 0.14 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.85 0.86 . . . . 65.51 108.836 -174.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -96.95 68.4 2.31 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.029 0.932 . . . . 55.23 110.427 -172.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 C-N-CA 123.252 0.621 . . . . 75.4 109.737 179.369 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 . . . . . 0 N--CA 1.481 1.092 0 N-CA-C 112.855 0.687 . . . . 75.32 112.855 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.69 -37.51 87.63 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.303 0.641 . . . . 71.44 110.441 -174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.646 ' HG ' ' SD ' ' A' ' 62' ' ' MET . 7.4 tt -62.46 -40.73 97.59 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.837 -1.074 . . . . 74.23 109.836 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.64 -32.0 71.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.692 0.797 . . . . 74.44 110.519 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -63.98 -40.01 95.42 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 119.336 -0.364 . . . . 75.5 110.659 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.498 HD13 ' HB3' ' A' ' 65' ' ' PHE . 29.4 mt -59.51 -46.05 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 CA-C-O 120.979 0.419 . . . . 74.12 110.493 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 4' ' ' LEU . 46.1 mm -61.98 -45.7 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.101 -0.954 . . . . 75.31 111.139 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.7 m -62.75 -53.04 60.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.791 0.836 . . . . 65.44 110.248 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.6 mt -50.13 -47.24 54.22 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 124.487 1.117 . . . . 73.53 110.221 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.444 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.42 -52.81 50.56 Favored Glycine 0 C--N 1.342 0.877 0 O-C-N 124.243 0.964 . . . . 75.14 113.809 -175.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.0 -40.28 94.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.585 0.354 . . . . 71.33 111.286 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 65.2 t -64.91 -38.52 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 115.798 -0.637 . . . . 52.21 110.825 176.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.557 HD11 ' O ' ' A' ' 69' ' ' LEU . 20.1 mt -63.65 -51.46 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.45 1.1 . . . . 74.02 110.079 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.512 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 69.8 t60 -54.91 -46.76 74.92 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.46 1.1 . . . . 73.31 109.632 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.1 tptm -62.63 -53.71 50.51 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 124.505 1.128 . . . . 73.43 111.91 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.6 ptp180 -74.48 -22.67 58.97 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.792 0.437 . . . . 64.34 111.772 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.511 ' SG ' HD23 ' A' ' 31' ' ' LEU . 52.4 t -67.0 -26.0 66.58 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.609 0.364 . . . . 50.33 111.292 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HG3' ' O ' ' A' ' 15' ' ' HIS . 44.4 mt-10 -74.32 5.72 4.3 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 112.966 0.728 . . . . 71.14 112.966 -175.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.479 ' HG3' ' NH1' ' A' ' 82' ' ' ARG . 14.8 pt-20 -86.15 -13.85 45.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.687 0.395 . . . . 74.34 111.439 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.527 ' HA ' ' HD2' ' A' ' 82' ' ' ARG . 14.2 mmt -76.24 95.07 3.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.846 0.458 . . . . 55.51 110.452 -176.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -73.07 -32.64 65.14 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.321 0.582 . . . . 74.24 109.937 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -94.61 153.8 17.67 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.335 -0.987 . . . . 71.14 108.335 166.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' HD11 ' A' ' 97' ' ' LEU . 95.3 m 60.51 55.33 3.46 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 124.131 0.894 . . . . 70.11 110.342 -170.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.81 -48.2 59.96 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.183 -0.917 . . . . 63.14 111.022 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.3 mtpm? -72.7 -32.99 66.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.881 0.472 . . . . 74.44 110.421 -173.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG2' HH12 ' A' ' 30' ' ' ARG . 48.0 mt-30 -71.64 -31.09 66.47 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.368 0.267 . . . . 74.44 111.174 172.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.6 t -67.41 -39.44 85.53 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.257 0.623 . . . . 63.54 110.532 173.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -74.4 -32.12 62.59 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 114.849 -1.069 . . . . 72.12 110.749 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.567 HH12 ' HG2' ' A' ' 27' ' ' GLN . 40.0 ttp-105 -77.61 -39.91 43.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.32 0.648 . . . . 74.41 110.205 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.511 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.6 tp -61.25 -47.14 87.38 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.713 -0.847 . . . . 73.11 108.713 172.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.37 -41.09 98.34 Favored Glycine 0 C--N 1.351 1.415 0 O-C-N 123.928 0.767 . . . . 54.53 113.004 176.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -59.98 -51.85 67.92 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.063 0.945 . . . . 74.44 110.677 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.584 ' NH2' ' HB3' ' A' ' 133' ' ' TRP . 34.9 mtt180 -59.78 -62.39 1.91 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.201 -1.363 . . . . 72.51 110.632 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.4 t -51.13 -46.31 31.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 124.453 1.096 . . . . 44.23 111.951 -173.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.559 HD23 HD11 ' A' ' 39' ' ' ILE . 94.7 mt -67.46 -44.25 79.1 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.415 0.447 . . . . 64.2 110.745 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.38 -19.44 62.13 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.266 0.354 . . . . 75.33 113.741 175.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 81.0 mt -86.69 -52.58 5.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.825 0.85 . . . . 71.35 111.995 177.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.559 HD11 HD23 ' A' ' 36' ' ' LEU . 12.7 pt -73.99 -46.69 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 118.758 -0.639 . . . . 72.23 111.769 -169.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.502 ' HE2' ' HB3' ' A' ' 36' ' ' LEU . 68.3 mttm -53.57 -50.22 84.38 Favored Pre-proline 0 N--CA 1.489 1.506 0 CA-C-O 118.416 -0.802 . . . . 63.13 113.094 -173.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.419 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 49.4 Cg_exo -55.87 -54.02 4.7 Favored 'Trans proline' 0 C--N 1.395 3.005 0 C-N-CA 121.963 1.775 . . . . 43.41 112.045 176.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HA ' HD12 ' A' ' 45' ' ' LEU . 4.3 mm? -64.39 -23.36 67.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.488 0.715 . . . . 62.23 111.647 -176.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 45.7 mt-10 -71.65 -44.18 64.77 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.739 0.816 . . . . 71.13 110.572 172.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 32.7 mmt -69.55 -26.89 64.71 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.529 0.518 . . . . 73.2 110.983 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 42' ' ' LEU . 39.2 mt -78.61 -37.14 43.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 64.03 109.987 176.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -68.84 -32.63 72.45 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 115.648 -0.705 . . . . 73.52 110.123 174.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 . . . . . 0 N--CA 1.478 0.933 0 C-N-CA 124.404 1.082 . . . . 73.35 110.907 -179.208 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 110.609 -0.145 . . . . 74.11 110.609 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.06 -42.73 77.09 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.796 0.438 . . . . 63.33 110.075 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.53 -45.68 88.38 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.09 -0.959 . . . . 64.33 111.75 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.445 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 97.6 mt -74.14 -37.08 64.15 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.816 0.846 . . . . 72.23 111.115 -172.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 67.0 m -62.6 -55.46 26.9 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.95 0.781 . . . . 71.41 109.203 175.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 26.4 m -62.89 -36.03 81.97 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.755 -0.657 . . . . 74.41 111.246 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.53 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.08 -48.93 74.27 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.388 0.675 . . . . 53.12 111.016 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.646 ' SD ' ' HG ' ' A' ' 4' ' ' LEU . 32.8 mmt -68.54 -30.08 68.79 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.548 -0.751 . . . . 72.34 111.992 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -76.37 -36.72 57.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.537 0.335 . . . . 70.43 111.165 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -67.41 -41.92 84.1 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.604 0.762 . . . . 71.45 109.512 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.513 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.03 -49.41 65.32 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.364 -0.834 . . . . 65.41 109.511 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.3 ttpp -53.59 -51.69 62.19 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.619 0.574 . . . . 73.1 110.267 178.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.98 89.51 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.263 0.977 . . . . 74.13 112.093 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.559 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.97 -44.5 92.56 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.755 0.822 . . . . 62.32 111.102 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.557 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -69.77 -29.45 66.79 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.247 -0.888 . . . . 75.42 110.708 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.7 mt-10 -65.76 -38.48 89.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.584 -0.697 . . . . 61.14 109.856 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.441 ' HB2' HG13 ' A' ' 101' ' ' VAL . 44.0 mt-10 -61.84 -52.2 65.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.45 -0.795 . . . . 73.42 110.144 174.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.7 79.93 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 123.876 0.735 . . . . 74.11 111.367 -178.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -59.64 -48.3 82.2 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.698 1.199 . . . . 61.31 110.645 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.23 91.71 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.195 -0.911 . . . . 35.31 113.18 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -67.77 -54.01 22.65 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 119.073 -0.489 . . . . 73.24 110.95 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.462 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -63.31 -33.71 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 112.02 0.378 . . . . 72.15 112.02 177.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.16 -33.22 75.5 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 120.973 0.416 . . . . 71.53 110.262 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -80.73 -27.78 36.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.5 0.72 . . . . 41.42 110.855 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.402 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.3 m-85 -87.1 9.4 19.96 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.004 0.922 . . . . 73.45 111.32 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -57.16 -16.79 8.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.073 0.949 . . . . 72.32 112.306 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -110.3 115.14 29.15 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 108.027 -1.101 . . . . 72.44 108.027 167.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.527 ' HD2' ' HA ' ' A' ' 21' ' ' MET . 1.0 OUTLIER -72.82 -24.65 60.93 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.423 0.689 . . . . 61.02 111.373 178.652 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 p -64.95 -37.47 87.75 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.311 0.644 . . . . 63.24 110.326 170.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.79 -38.28 86.21 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.856 0.862 . . . . 65.32 110.601 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.486 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.2 mt -57.7 -49.16 81.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 108.862 -0.792 . . . . 74.12 108.862 175.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.01 -35.08 79.02 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.425 0.453 . . . . 74.15 111.606 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -60.8 -45.11 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.699 0.624 . . . . 74.42 111.054 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.411 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -80.54 -27.51 37.56 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 110.384 -0.228 . . . . 62.22 110.384 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 14.6 tp -67.61 -44.25 78.5 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.518 1.127 . . . . 52.15 111.164 -171.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -65.63 -13.58 59.41 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.868 -1.06 . . . . 74.31 111.65 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.26 -21.75 12.4 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.082 0.953 . . . . 74.31 111.402 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.478 0.935 0 C-N-CA 123.948 0.899 . . . . 53.11 110.147 -175.623 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.541 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 7.0 mt . . . . . 0 C--O 1.242 0.696 0 N-CA-C 108.259 -1.015 . . . . 71.11 108.259 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.557 HD11 ' SG ' ' A' ' 24' ' ' CYS . 20.2 mt -65.87 -54.1 31.11 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 122.142 0.972 . . . . 73.21 109.621 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.478 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 21.9 m-85 -94.44 36.72 1.14 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.628 -1.624 . . . . 74.24 109.947 -174.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.541 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 1.6 tmmt? -52.53 -62.46 1.63 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.152 0.433 . . . . 74.35 110.844 -176.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -61.85 -60.84 3.05 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.262 0.625 . . . . 74.43 110.802 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.9 t -50.34 -57.85 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.898 1.279 . . . . 64.42 112.807 -174.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.458 ' HA ' HD13 ' A' ' 105' ' ' LEU . 65.3 t30 -73.83 -22.25 59.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.985 -1.007 . . . . 64.44 110.349 -174.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.1 -43.65 95.39 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.203 -0.427 . . . . 73.25 110.126 166.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -56.75 -46.91 81.11 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 119.386 -0.34 . . . . 71.21 110.665 172.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.559 HD12 ' HB1' ' A' ' 68' ' ' ALA . 9.9 mp -53.21 -41.66 65.55 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 117.784 0.265 . . . . 52.2 111.142 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.439 ' HA ' ' HE3' ' A' ' 133' ' ' TRP . 38.9 t -67.53 -43.94 79.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.884 0.874 . . . . 43.45 111.577 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 68.7 m-20 -69.79 -55.16 10.59 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.411 -0.813 . . . . 72.35 110.243 -177.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.407 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.7 t -63.28 -32.75 57.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 119.532 -0.271 . . . . 54.53 111.225 -176.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 16.4 t-105 -67.46 -48.18 67.95 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.02 -0.514 . . . . 74.44 111.738 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 41.4 pttt -60.72 -42.09 96.58 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 109.327 -0.62 . . . . 74.44 109.327 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.39 -35.56 75.91 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.391 1.076 . . . . 71.53 110.607 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.53 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.3 OUTLIER -61.14 -59.81 4.74 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 107.948 -1.131 . . . . 65.21 107.948 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.9 t -53.97 -35.49 61.87 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.905 -1.498 . . . . 62.41 110.973 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.2 mt -63.22 -62.95 1.35 Allowed 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.154 0.582 . . . . 62.41 111.533 172.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.48 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 3.8 pp -63.19 -28.61 70.16 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.134 0.42 . . . . 73.13 112.134 -173.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 91.7 mt -65.28 -57.9 7.28 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.292 -0.867 . . . . 72.34 109.878 173.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -68.17 -23.72 64.89 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 112.18 0.437 . . . . 72.34 112.18 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 85.4 t -83.94 -63.96 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.376 0.271 . . . . 71.21 111.003 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -93.87 -44.48 8.08 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 122.253 -0.279 . . . . 52.35 111.537 -170.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -71.21 -17.63 62.51 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 116.674 -0.239 . . . . 73.15 110.481 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 65.82 9.73 6.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.741 1.617 . . . . 74.21 111.363 -177.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.416 ' HA ' ' HD3' ' A' ' 123' ' ' PRO . 33.1 ttp -94.61 111.12 52.81 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.476 1.11 . . . . 75.35 109.432 -170.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 41.2 Cg_endo . . . . . 0 C--N 1.366 1.465 0 C-N-CA 124.004 3.136 . . . . 72.24 112.915 -165.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.584 ' HB3' ' NH2' ' A' ' 34' ' ' ARG . 12.3 m0 . . . . . 0 CA--C 1.548 0.881 0 N-CA-C 113.983 1.105 . . . . 75.53 113.983 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.35 93.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.289 0.236 . . . . 65.13 110.792 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -72.58 -32.34 65.93 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.393 0.677 . . . . 64.15 111.319 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HG2' ' HD2' ' A' ' 30' ' ' ARG . 29.4 tt0 -61.99 -58.67 6.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.694 0.798 . . . . 75.32 109.973 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -37.83 83.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.061 0.544 . . . . 75.1 111.835 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 142' ' ' ASP . 33.3 tt0 -56.01 -63.76 1.08 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.79 0.681 . . . . 73.4 110.948 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -71.46 -46.19 60.6 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.524 0.515 . . . . 73.44 110.862 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.94 -43.01 72.48 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.923 -0.58 . . . . 61.44 111.129 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 96' ' ' ILE . . . -78.05 -25.36 47.71 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 123.212 0.32 . . . . 71.2 111.096 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 138' ' ' GLN . 13.6 t70 -58.21 -53.72 55.1 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.318 -0.623 . . . . 70.22 109.318 170.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -58.65 -44.61 90.16 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 114.341 -1.3 . . . . 72.41 111.693 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 34.0 t70 -80.88 -32.25 34.97 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.952 0.782 . . . . 72.43 112.87 -168.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' A' ' 89' ' ' LEU . 3.6 tmt_? -70.2 -41.33 73.82 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.288 -1.005 . . . . 74.44 108.288 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 ttm180 -62.42 -37.44 85.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 114.726 -1.124 . . . . 73.23 109.954 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.87 -17.82 59.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.438 0.695 . . . . 73.34 111.396 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.488 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 1.6 t80 -69.98 -59.81 2.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.238 -1.023 . . . . 63.35 108.238 171.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.92 -38.65 72.95 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 113.874 -1.512 . . . . 52.33 111.595 -170.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 87.4 mmm -103.55 31.7 4.25 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.196 0.999 . . . . 71.23 110.131 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 2.0 tt . . . . . 0 C--N 1.36 1.035 0 CA-C-O 121.583 0.706 . . . . 65.21 109.574 -179.069 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 . . . . . 0 N--CA 1.473 0.695 0 CA-C-O 119.772 -0.156 . . . . 64.44 111.238 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -59.65 -35.03 73.6 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.784 0.677 . . . . 73.44 111.562 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 30.5 tp -66.71 -44.56 81.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.888 0.475 . . . . 65.31 110.549 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -70.21 -25.35 63.36 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.791 0.436 . . . . 74.23 110.633 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -77.64 -29.96 51.98 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-O 118.993 -0.527 . . . . 72.13 110.768 173.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.46 -44.91 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 109.2 -0.667 . . . . 74.43 109.2 170.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 mm -60.42 -51.52 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-N 114.5 -1.227 . . . . 64.54 110.842 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.8 m -65.09 -56.77 11.09 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.329 0.652 . . . . 65.33 111.075 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.2 mt -51.7 -51.54 55.22 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.965 0.906 . . . . 72.3 111.199 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.26 -35.24 90.06 Favored Glycine 0 C--N 1.346 1.126 0 O-C-N 124.272 0.983 . . . . 74.12 114.05 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -69.16 -42.8 75.44 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.22 0.533 . . . . 65.13 109.729 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 62.8 t -62.06 -37.72 79.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-N 114.923 -1.035 . . . . 74.13 110.139 174.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.457 HG12 HD11 ' A' ' 76' ' ' ILE . 32.8 mt -58.04 -52.21 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.758 0.823 . . . . 73.14 110.131 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -60.16 -36.29 77.23 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.004 0.815 . . . . 73.32 110.982 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -66.29 -66.98 0.48 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 119.541 -0.266 . . . . 71.34 111.454 175.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -63.78 -20.17 65.56 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.355 0.872 . . . . 73.25 113.355 -172.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.5 t -65.33 -20.53 66.44 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.067 0.547 . . . . 72.21 112.077 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.28 -18.07 24.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.781 0.832 . . . . 65.23 113.07 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -65.85 -21.51 66.47 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.337 0.866 . . . . 62.31 113.337 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.525 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 7.6 mmt -75.57 87.7 2.68 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 121.16 0.505 . . . . 54.14 110.493 -173.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -35.59 63.79 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.787 -1.097 . . . . 70.41 108.447 170.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -92.64 152.89 19.31 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 108.129 -1.063 . . . . 71.2 108.129 169.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.5 p 50.54 60.11 4.09 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.243 1.017 . . . . 45.13 110.413 -171.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 47.4 mtmt -66.58 -45.32 79.62 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 114.491 -1.231 . . . . 61.21 111.371 -174.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -71.42 -36.8 71.43 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 108.194 -1.039 . . . . 72.0 108.194 -170.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.479 HE22 ' HB2' ' A' ' 141' ' ' ALA . 0.0 OUTLIER -56.45 -43.86 79.94 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.066 1.346 . . . . 73.01 112.231 169.092 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 32.8 t -60.94 -39.79 90.83 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.683 0.793 . . . . 72.34 110.889 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.9 mpt_? -81.23 -22.44 38.76 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.628 0.771 . . . . 74.54 111.1 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.45 -60.45 2.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.632 0.773 . . . . 73.3 109.166 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 29.0 tp -58.23 -40.52 81.9 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.425 1.09 . . . . 73.43 110.196 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.04 -51.04 59.73 Favored Glycine 0 C--N 1.354 1.54 0 O-C-N 123.965 0.791 . . . . 71.15 112.458 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -71.59 -32.99 68.65 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.082 0.553 . . . . 74.4 111.387 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.796 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.9 mtt180 -62.37 -63.58 1.19 Allowed 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.419 0.449 . . . . 61.42 109.812 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 14' ' ' ILE . 99.8 t -65.09 -41.14 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.549 -0.75 . . . . 72.44 111.219 -173.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.8 -40.94 98.9 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.344 0.592 . . . . 73.31 109.893 175.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.1 -22.09 75.84 Favored Glycine 0 C--O 1.216 -1.006 0 CA-C-N 114.702 -1.135 . . . . 51.21 113.083 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 90.5 mt -84.42 -39.7 18.68 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 117.838 0.819 . . . . 62.31 111.372 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 pt -81.66 -39.18 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 112.447 0.536 . . . . 74.53 112.447 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 44' ' ' MET . 31.2 mmtp -60.07 -53.79 61.7 Favored Pre-proline 0 N--CA 1.485 1.304 0 CA-C-O 118.004 -0.998 . . . . 71.4 112.518 -174.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 27.2 Cg_endo -60.17 -41.26 52.95 Favored 'Trans proline' 0 C--N 1.399 3.222 0 C-N-CA 122.08 1.853 . . . . 72.23 110.539 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.46 HD13 HD11 ' A' ' 45' ' ' LEU . 3.9 mm? -60.67 -35.66 76.8 Favored 'General case' 0 C--N 1.356 0.868 0 O-C-N 124.286 0.991 . . . . 75.21 111.667 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.16 -44.9 67.84 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.798 0.439 . . . . 73.43 110.943 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 36.2 mmt -57.13 -51.76 68.02 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.099 0.874 . . . . 74.34 110.265 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 41' ' ' PRO . 3.5 pp -77.16 -27.5 53.82 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.203 -0.453 . . . . 71.15 111.721 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -59.45 -39.14 82.64 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.654 0.661 . . . . 72.44 110.153 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 . . . . . 0 CA--C 1.544 0.723 0 CA-C-N 115.157 -0.929 . . . . 62.43 111.562 -177.78 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 p . . . . . 0 N--CA 1.474 0.763 0 N-CA-C 110.321 -0.251 . . . . 64.21 110.321 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -57.09 -51.33 69.74 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.15 0.58 . . . . 71.12 110.918 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -72.25 -27.25 62.39 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.33 -0.85 . . . . 55.44 111.883 -179.169 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.547 HD13 HD11 ' A' ' 115' ' ' LEU . 52.8 tp -72.55 -43.6 63.25 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.885 -0.413 . . . . 71.44 109.885 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.3 m -62.17 -49.68 74.85 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 123.787 0.835 . . . . 74.11 109.36 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 54.8 m -54.71 -44.93 73.89 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.038 0.935 . . . . 74.13 110.826 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.89 -38.57 89.09 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.634 0.774 . . . . 63.14 111.198 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.82 -30.44 66.87 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.914 0.485 . . . . 72.51 111.007 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -68.33 -45.99 71.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.039 0.536 . . . . 74.11 109.87 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -67.91 -39.38 83.58 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.469 -0.787 . . . . 73.53 111.32 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.415 ' CZ ' HD13 ' A' ' 38' ' ' LEU . 1.2 t80 -68.47 -46.42 69.81 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.154 0.982 . . . . 71.1 109.531 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -60.94 -44.83 96.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.894 1.278 . . . . 73.41 111.036 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.3 -38.47 90.31 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.235 0.614 . . . . 74.42 111.083 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.571 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.85 -33.93 76.68 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.335 -0.848 . . . . 51.22 110.947 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.74 -35.82 75.31 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.944 -0.571 . . . . 73.14 110.994 174.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.07 -38.56 91.51 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 122.951 0.5 . . . . 71.11 110.981 176.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.24 -51.4 67.91 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 123.959 0.787 . . . . 74.3 109.943 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.63 -35.85 79.08 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.597 0.759 . . . . 62.41 111.537 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -69.05 -41.58 77.45 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.773 1.229 . . . . 53.42 110.358 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.08 -33.8 65.04 Favored Glycine 0 C--N 1.347 1.171 0 CA-C-N 115.109 -0.951 . . . . 61.12 112.224 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -62.69 -50.85 69.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.089 0.556 . . . . 52.12 111.408 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.543 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -71.98 -28.01 28.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 112.231 0.456 . . . . 70.53 112.231 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.435 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 39.5 tt0 -62.83 -36.72 84.13 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.668 0.747 . . . . 52.42 109.583 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -77.8 -39.13 44.9 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 114.359 -1.291 . . . . 74.52 110.698 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 15.1 m-30 -76.59 -3.52 38.06 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 124.309 1.044 . . . . 61.51 112.081 -177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.4 p -56.04 -31.36 63.06 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 121.507 0.67 . . . . 70.34 109.765 171.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.21 104.64 16.56 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.438 -1.319 . . . . 73.41 107.438 166.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -22.43 64.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.417 0.687 . . . . 70.25 110.724 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.7 m -58.62 -39.4 80.36 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.305 1.042 . . . . 65.3 110.966 170.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.13 -41.38 97.23 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 124.151 0.98 . . . . 64.24 110.818 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 29.0 mt -58.78 -51.17 75.35 Favored 'Isoleucine or valine' 0 C--N 1.362 1.11 0 O-C-N 123.956 0.785 . . . . 65.22 109.402 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 48.3 t -55.67 -46.18 77.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.88 0.872 . . . . 62.41 111.522 178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -59.32 -42.96 92.64 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.662 -1.154 . . . . 64.14 111.832 -176.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -24.89 27.48 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 119.305 -0.379 . . . . 73.34 110.513 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 16.5 tp -67.46 -39.27 85.32 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.493 0.717 . . . . 71.14 110.859 -172.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.8 t -65.81 -26.15 67.55 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 115.363 -0.835 . . . . 54.14 111.18 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.15 -3.99 30.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.157 0.983 . . . . 73.12 111.64 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 N--CA 1.47 0.575 0 N-CA-C 109.633 -0.506 . . . . 75.34 109.633 -175.415 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 108.858 -0.793 . . . . 74.21 108.858 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 98' ' ' PHE . 39.1 mt -61.95 -43.65 98.4 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.829 0.823 . . . . 72.24 110.41 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.4 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 12.7 m-85 -105.58 45.31 0.98 Allowed 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.143 -1.39 . . . . 73.01 108.933 -177.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.15 -66.72 0.35 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 118.483 0.583 . . . . 72.52 110.35 -170.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 36.1 t70 -73.07 -41.04 64.55 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.713 0.633 . . . . 74.13 111.028 -176.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.42 -58.56 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 123.839 0.712 . . . . 75.4 110.902 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -74.95 -20.79 59.53 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.979 0.912 . . . . 61.33 111.274 -176.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -64.42 -37.12 86.42 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 108.936 -0.765 . . . . 74.3 108.936 167.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 61.1 mtpt -71.75 -37.01 70.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.2 0.6 . . . . 73.11 110.721 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.571 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -58.35 -47.44 83.78 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.938 -0.393 . . . . 74.14 109.938 171.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.796 ' HB2' HH12 ' A' ' 34' ' ' ARG . 35.1 t -66.55 -38.97 88.25 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.744 0.818 . . . . 75.44 111.362 -177.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.749 ' HA ' ' HE3' ' A' ' 110' ' ' LYS . 39.1 t70 -69.4 -55.46 10.28 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.007 0.923 . . . . 55.51 110.197 -175.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.44 -22.84 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-N 115.22 -0.9 . . . . 64.13 110.598 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 43.8 t-105 -70.56 -38.14 74.1 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 118.907 -0.568 . . . . 71.34 111.153 171.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' A' ' 107' ' ' ASP . 10.0 mtmp? -58.92 -47.3 85.49 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 118.536 0.607 . . . . 72.21 110.085 172.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 12.6 mm-40 -58.02 -49.87 75.37 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.329 1.018 . . . . 72.53 110.332 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.8 OUTLIER -54.75 -61.72 2.13 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 124.258 0.974 . . . . 54.32 109.727 176.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -53.47 -39.59 64.63 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.541 1.136 . . . . 65.55 112.091 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.56 -60.41 3.38 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.969 0.507 . . . . 71.24 111.125 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.547 HD11 HD13 ' A' ' 58' ' ' LEU . 4.1 pp -65.26 -37.16 86.36 Favored 'General case' 0 CA--C 1.559 1.297 0 CA-C-O 120.877 0.37 . . . . 51.43 111.492 -173.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.649 HD22 ' SD ' ' A' ' 122' ' ' MET . 95.1 mt -65.39 -49.11 70.52 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.185 0.994 . . . . 61.41 111.131 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -73.83 -40.06 63.6 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 112.454 0.538 . . . . 62.44 112.454 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 78.9 t -71.5 -53.56 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 122.582 0.353 . . . . 71.12 111.06 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -87.66 -57.68 2.85 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.079 0.466 . . . . 54.4 111.284 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.47 HE22 HD22 ' A' ' 58' ' ' LEU . 64.8 mt-30 -84.66 -13.2 52.2 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.348 -0.842 . . . . 65.03 111.336 -172.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 60.82 35.32 19.47 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 124.765 1.226 . . . . 74.23 112.016 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.649 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.4 mtp -78.06 112.77 27.76 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 115.262 -0.881 . . . . 75.33 109.952 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo . . . . . 0 C--N 1.369 1.647 0 C-N-CA 122.703 2.269 . . . . 62.45 110.637 -179.094 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.406 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER . . . . . 0 CA--C 1.548 0.871 0 N-CA-C 111.752 0.279 . . . . 74.11 111.752 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.42 -40.37 57.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.325 0.65 . . . . 40.21 111.282 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -64.24 -39.26 93.59 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.791 0.836 . . . . 71.31 110.668 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -52.16 -57.05 10.81 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 124.6 1.188 . . . . 75.21 110.881 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -69.25 -35.71 76.39 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 124.343 1.027 . . . . 71.35 113.542 -171.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.1 -37.56 69.53 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 118.558 0.617 . . . . 72.44 111.049 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -75.73 -36.35 59.95 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.417 0.627 . . . . 64.42 110.517 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 143' ' ' GLU . 14.2 t70 -62.18 -48.49 79.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.235 1.414 . . . . 75.33 109.838 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.479 ' HB2' HE22 ' A' ' 27' ' ' GLN . . . -74.86 -24.34 58.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.235 -1.348 . . . . 72.31 112.205 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.97 -45.76 93.46 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.861 -0.792 . . . . 44.24 108.861 168.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 140' ' ' ASP . 22.2 mm-40 -57.9 -54.16 50.08 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.182 -0.917 . . . . 75.04 111.291 175.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -62.09 -45.44 93.49 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 123.783 0.677 . . . . 72.54 112.5 -176.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -56.59 -54.3 47.53 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.768 0.827 . . . . 73.23 110.886 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -71.9 -30.22 65.14 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.834 -0.621 . . . . 62.32 111.308 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.47 -25.4 59.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.089 0.556 . . . . 72.02 110.957 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -57.8 3.59 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.263 0.625 . . . . 64.24 109.585 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . 0.443 ' NE2' HD23 ' A' ' 89' ' ' LEU . 25.5 mm-40 -62.72 -52.14 64.42 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.352 -0.84 . . . . 64.22 110.65 -175.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 96.0 mmm -100.62 79.33 2.08 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.542 -1.281 . . . . 65.51 107.542 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 31.5 tp . . . . . 0 CA--C 1.536 0.406 0 CA-C-N 115.375 -0.829 . . . . 72.22 109.65 -178.924 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.128 -0.323 . . . . 75.32 110.128 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -70.44 -55.47 8.93 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.701 -0.851 . . . . 73.21 108.701 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.1 mt -60.07 -32.21 70.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.145 0.903 . . . . 72.23 112.153 177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -61.48 -53.37 57.28 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 109.398 -0.593 . . . . 64.31 109.398 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -67.66 -36.45 80.75 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 123.828 0.705 . . . . 71.02 111.469 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.0 mt -56.89 -54.14 33.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.813 0.845 . . . . 54.14 110.843 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 42.1 mm -67.21 -38.97 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 115.085 -0.961 . . . . 70.23 110.94 -177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.0 m -62.61 -47.39 83.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.279 0.632 . . . . 71.03 110.552 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.11 -60.63 3.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.659 0.783 . . . . 63.51 110.09 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.78 -41.22 95.85 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 124.515 1.134 . . . . 41.24 113.898 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.436 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 5.9 tp-100 -61.03 -56.15 24.36 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.649 -0.5 . . . . 73.54 109.649 178.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 85.3 t -62.98 -27.65 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 CA-C-N 115.263 -0.88 . . . . 75.13 111.393 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 69' ' ' LEU . 27.7 mt -60.93 -54.14 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.751 0.82 . . . . 64.44 109.618 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -58.15 -39.97 80.17 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 124.091 0.869 . . . . 74.11 110.508 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.436 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.4 mptm? -61.52 -51.43 68.65 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 123.826 0.704 . . . . 51.34 112.408 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 14.7 ptp180 -81.81 -15.71 53.27 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.411 0.523 . . . . 75.11 112.411 -176.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.619 ' SG ' HD23 ' A' ' 31' ' ' LEU . 45.4 t -69.69 -23.52 63.45 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.355 0.662 . . . . 71.24 110.829 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -65.17 -11.06 36.44 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.772 0.429 . . . . 72.51 112.127 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -30.58 71.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.47 0.708 . . . . 54.45 111.849 173.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.2 mmt -67.91 89.42 0.28 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.154 0.502 . . . . 65.44 111.401 -172.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.61 -20.26 61.32 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.709 -1.132 . . . . 74.1 110.574 169.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.6 m-85 -121.19 147.82 45.09 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.362 1.065 . . . . 63.35 108.396 177.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.615 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 96.8 m 59.09 59.06 2.88 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 124.812 1.32 . . . . 75.14 110.337 -166.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 26' ' ' LYS . 44.1 pttt -70.29 -40.14 74.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.174 -1.376 . . . . 72.14 111.782 -174.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 25' ' ' LYS . 60.1 tttm -78.02 -34.83 50.48 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.37 0.268 . . . . 73.15 110.305 -170.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -76.1 -25.48 55.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.339 0.656 . . . . 63.32 111.023 174.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 38.4 t -69.7 -44.27 70.73 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.743 0.817 . . . . 35.43 110.766 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.84 -33.3 70.52 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.635 0.774 . . . . 73.32 110.484 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.78 -44.33 93.71 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.56 0.744 . . . . 75.13 110.009 175.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.619 HD23 ' SG ' ' A' ' 18' ' ' CYS . 25.5 tp -59.1 -44.88 91.99 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 109.111 -0.699 . . . . 64.32 109.111 172.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.93 -47.53 88.32 Favored Glycine 0 C--N 1.353 1.486 0 O-C-N 124.148 0.905 . . . . 71.34 113.533 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -66.2 -39.68 89.83 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.181 0.592 . . . . 71.34 111.268 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.57 HH12 ' HB2' ' A' ' 106' ' ' SER . 36.5 mtt180 -61.3 -62.01 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.408 0.443 . . . . 72.04 110.478 174.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 64.9 t -53.88 -41.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.627 1.171 . . . . 45.44 112.225 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 39' ' ' ILE . 95.9 mt -68.64 -39.82 80.55 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.516 0.326 . . . . 73.42 110.611 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.07 -19.26 65.72 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-N 116.744 -0.207 . . . . 50.12 113.151 173.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 34' ' ' ARG . 5.2 mp -84.41 -53.53 5.39 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.452 1.101 . . . . 71.43 111.103 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 36' ' ' LEU . 15.2 pt -83.69 -42.81 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 118.404 -0.808 . . . . 70.52 112.328 -168.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 44' ' ' MET . 55.1 mtmt -52.41 -53.23 55.48 Favored Pre-proline 0 N--CA 1.49 1.552 0 CA-C-O 118.116 -0.945 . . . . 73.04 112.853 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.73 -43.22 51.85 Favored 'Trans proline' 0 C--N 1.398 3.146 0 C-N-CA 122.175 1.917 . . . . 74.44 111.7 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.15 -29.08 67.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.322 -0.853 . . . . 70.51 112.081 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 51.1 mt-10 -76.0 -38.06 57.76 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.661 0.785 . . . . 71.34 110.474 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 26.4 mmt -62.63 -36.31 82.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.596 -0.729 . . . . 74.5 110.111 177.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -80.6 -33.73 35.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.719 0.808 . . . . 70.3 111.042 176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.02 -32.93 74.7 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.563 1.145 . . . . 75.03 111.223 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.5 t70 . . . . . 0 C--N 1.357 0.901 0 O-C-N 124.046 0.842 . . . . 74.33 110.886 -179.599 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 109.605 -0.517 . . . . 71.44 109.605 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.51 -39.47 83.95 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.083 0.553 . . . . 54.52 111.681 -174.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -71.41 -36.03 71.2 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.673 0.789 . . . . 74.21 111.807 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.54 -46.07 87.67 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.211 -1.033 . . . . 64.14 108.211 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.5 m -69.28 -40.27 77.84 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 114.348 -1.296 . . . . 74.44 110.873 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.6 m -60.32 -43.15 96.65 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.268 0.627 . . . . 70.23 110.811 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.64 88.97 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 123.778 0.673 . . . . 54.42 109.998 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.459 ' SD ' HD11 ' A' ' 112' ' ' LEU . 26.3 mmt -64.27 -25.07 67.89 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.266 -0.879 . . . . 74.23 112.362 176.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.54 -44.13 29.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.287 0.635 . . . . 73.31 110.693 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -59.18 -45.09 91.94 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.875 0.734 . . . . 74.45 109.401 175.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -61.18 -50.76 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 113.245 -1.798 . . . . 63.35 110.746 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -58.56 -48.65 80.22 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.939 1.296 . . . . 75.14 110.624 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.28 -39.39 93.84 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.351 0.661 . . . . 74.2 111.743 -177.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -69.72 -34.3 73.69 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.707 -0.679 . . . . 72.22 110.911 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.5 ' O ' HD11 ' A' ' 14' ' ' ILE . 89.8 mt -69.48 -34.09 73.84 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.732 0.413 . . . . 72.03 110.74 174.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.77 -40.57 97.0 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.834 0.35 . . . . 74.51 110.751 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.88 -39.97 87.67 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.67 -0.695 . . . . 65.21 111.175 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.26 -39.32 89.39 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.258 0.623 . . . . 75.42 110.998 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -62.43 -44.56 96.13 Favored 'General case' 0 C--N 1.351 0.65 0 O-C-N 124.565 1.166 . . . . 73.52 109.38 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.6 -36.8 93.82 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.781 -0.645 . . . . 72.52 112.957 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.34 -52.93 63.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.69 0.396 . . . . 74.01 110.884 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.409 HG23 ' CE2' ' A' ' 98' ' ' PHE . 0.3 OUTLIER -66.75 -26.48 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 112.73 0.641 . . . . 73.42 112.73 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.35 -36.02 82.32 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.087 0.47 . . . . 63.52 111.163 170.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -76.74 -38.56 54.0 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.733 0.813 . . . . 73.13 111.024 175.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.18 -0.86 37.92 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.871 0.868 . . . . 73.23 113.033 -173.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 p -58.2 -29.28 65.55 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.054 0.454 . . . . 33.31 110.608 169.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -82.29 110.35 17.38 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 115.086 -0.961 . . . . 51.13 108.76 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -69.85 -31.73 69.73 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.775 0.83 . . . . 75.54 111.122 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.0 p -67.73 -37.85 82.74 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.151 0.98 . . . . 52.12 111.18 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -61.76 -38.48 88.17 Favored 'General case' 0 C--O 1.25 1.114 0 C-N-CA 123.456 0.702 . . . . 75.25 111.05 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.496 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 22.6 mt -59.84 -49.7 82.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 CA-C-N 115.529 -0.759 . . . . 64.3 109.724 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.8 t -62.15 -35.06 77.63 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.222 0.609 . . . . 64.43 111.562 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -64.33 -47.72 78.31 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 124.055 0.847 . . . . 72.35 111.268 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.77 -32.44 59.94 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 110.002 -0.369 . . . . 71.44 110.002 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 9.7 tp -61.96 -50.62 71.39 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 124.184 0.994 . . . . 73.04 110.033 -174.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -61.23 -29.01 69.57 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 115.932 -0.576 . . . . 75.14 112.25 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.2 -54.48 6.44 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.355 0.662 . . . . 60.22 111.356 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 CA--C 1.546 0.789 0 C-N-CA 123.61 0.764 . . . . 74.44 109.622 -178.452 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.496 HG13 ' HB2' ' A' ' 141' ' ' ALA . 3.0 mp . . . . . 0 CA--C 1.552 1.024 0 N-CA-C 107.551 -1.277 . . . . 75.12 107.551 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -55.8 -31.4 62.61 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.855 0.862 . . . . 61.34 112.049 -173.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.415 ' CZ ' HD22 ' A' ' 31' ' ' LEU . 91.2 m-85 -125.57 25.54 6.97 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.107 -0.949 . . . . 71.11 110.694 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.28 -64.02 0.35 Allowed 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 125.488 1.515 . . . . 63.13 113.607 -163.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -67.31 -48.87 66.32 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.129 0.972 . . . . 73.52 111.553 -170.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.06 -43.38 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 114.765 -1.107 . . . . 65.44 110.875 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.519 ' HA ' ' HB2' ' A' ' 105' ' ' LEU . 67.3 t30 -78.34 -18.32 55.32 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.986 1.315 . . . . 73.35 110.212 -176.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.05 -39.78 72.07 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.746 -1.205 . . . . 61.43 107.746 168.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.73 -39.69 94.07 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.516 0.51 . . . . 72.41 110.523 170.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 102' ' ' ASN . 9.4 mp -60.07 -43.92 95.11 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 109.766 -0.457 . . . . 73.33 109.766 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.57 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.4 t -66.04 -47.5 74.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.116 0.566 . . . . 70.13 110.789 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.35 -57.35 7.65 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.642 1.177 . . . . 75.2 110.966 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.8 t -63.52 -39.85 86.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-N 115.566 -0.743 . . . . 72.04 111.258 -177.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.2 t-105 -69.37 -39.05 78.29 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-O 118.543 -0.741 . . . . 73.41 111.88 -178.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -38.47 83.63 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 119.4 1.0 . . . . 72.42 110.534 175.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -60.5 -46.58 89.58 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.03 0.532 . . . . 73.25 110.903 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 8.4 tt -70.39 -48.2 57.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.595 1.158 . . . . 73.41 109.936 -172.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.1 p -65.63 -43.1 90.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.724 0.81 . . . . 73.0 110.891 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.7 mt -68.87 -35.33 76.77 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.234 -0.413 . . . . 72.42 112.041 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.67 -21.78 59.23 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-N 118.705 0.684 . . . . 75.43 110.896 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.0 mt -70.93 -35.33 72.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.916 -0.401 . . . . 65.24 109.916 167.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -29.81 65.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.73 0.812 . . . . 53.24 111.662 176.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 t -85.2 -62.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 122.728 0.411 . . . . 65.02 110.957 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -75.93 -56.14 4.95 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.203 0.601 . . . . 73.15 111.687 -170.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -85.12 -18.24 34.83 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.177 0.591 . . . . 74.12 110.808 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 61.52 16.22 7.41 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.63 1.572 . . . . 74.55 112.798 -177.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 36.6 mtm -71.84 140.83 83.94 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.522 -0.547 . . . . 73.32 109.522 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo . . . . . 0 C--N 1.371 1.747 0 C-N-CA 123.499 2.799 . . . . 51.42 112.813 -176.748 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.9 m0 . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 113.077 0.769 . . . . 74.3 113.077 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.44 -37.11 82.48 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 122.785 0.434 . . . . 44.34 111.877 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -74.58 -43.58 54.95 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.904 0.482 . . . . 74.14 111.269 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -63.07 -53.71 49.46 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.502 0.721 . . . . 61.4 110.976 -174.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.83 -29.73 68.46 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.541 0.737 . . . . 74.21 112.461 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -71.52 -45.25 62.9 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 123.757 0.661 . . . . 74.03 110.729 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -68.27 -35.75 78.37 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.026 -0.533 . . . . 73.31 110.548 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.47 -45.0 81.17 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.39 -0.823 . . . . 74.31 109.043 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.496 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -57.69 -40.89 80.47 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 124.272 0.982 . . . . 62.24 111.181 178.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.77 -60.6 3.27 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 124.084 0.865 . . . . 72.43 110.903 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.76 -46.73 86.8 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.261 1.024 . . . . 74.24 111.689 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -78.58 -27.22 45.64 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.185 -1.371 . . . . 64.42 110.84 -170.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 57.0 ttt85 -61.68 -47.8 83.68 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 115.939 -0.573 . . . . 73.4 109.681 167.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -62.84 -37.3 86.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.766 0.666 . . . . 54.15 110.688 176.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.45 -20.91 62.86 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.779 0.675 . . . . 75.1 111.684 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.615 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -84.85 -62.45 1.54 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.804 0.275 . . . . 73.5 110.552 172.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -68.26 -24.3 64.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.432 1.093 . . . . 64.43 111.485 -166.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 44.0 ttm -139.57 83.22 1.92 Allowed 'General case' 0 C--O 1.24 0.554 0 N-CA-C 107.378 -1.342 . . . . 65.31 107.378 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 1.3 tt . . . . . 0 CA--C 1.545 0.755 0 CA-C-N 115.614 -0.721 . . . . 75.02 109.303 -172.773 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 . . . . . 0 N--CA 1.487 1.407 0 N-CA-C 111.559 0.207 . . . . 63.11 111.559 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.19 -57.35 11.49 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.604 1.162 . . . . 64.44 108.776 171.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.94 -44.25 97.15 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 114.961 -1.018 . . . . 72.51 110.5 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -58.31 -51.19 70.84 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.571 0.545 . . . . 73.43 111.07 -175.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 22.0 m-70 -67.9 -52.1 40.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.032 0.533 . . . . 72.31 111.182 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.8 mt -53.61 -50.21 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 124.12 0.968 . . . . 74.52 111.86 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.455 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 99.6 mt -63.68 -46.44 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.545 -0.74 . . . . 74.32 109.667 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -51.63 -44.17 62.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 123.754 0.659 . . . . 52.21 110.571 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 84.6 mt -59.85 -50.9 71.99 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.729 0.643 . . . . 74.3 110.307 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.78 -33.82 87.0 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 124.385 1.053 . . . . 62.21 113.629 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 19.3 mm-40 -64.9 -52.79 54.59 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.668 -0.864 . . . . 71.54 108.668 176.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.71 -34.63 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.354 1.062 . . . . 53.44 110.946 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.71 -51.6 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 123.983 0.913 . . . . 74.24 109.736 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -64.06 -36.4 83.88 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.815 0.697 . . . . 73.54 110.346 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.1 mmmt -79.65 -29.05 40.84 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.352 0.661 . . . . 65.34 112.653 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 20' ' ' GLU . 11.6 ptm180 -87.98 -20.97 25.14 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.219 -0.301 . . . . 71.24 110.756 174.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 36.5 t -74.05 -20.26 60.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.781 0.832 . . . . 51.22 110.927 175.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -48.85 -36.43 16.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.832 0.853 . . . . 75.4 112.402 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HB2' ' NH2' ' A' ' 82' ' ' ARG . 12.8 pt-20 -76.83 -3.37 38.1 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.464 0.913 . . . . 75.13 113.464 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 18.6 mmt -74.98 83.91 2.25 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.64 -0.504 . . . . 63.22 109.64 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -70.1 -36.45 74.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.929 -0.767 . . . . 73.33 108.929 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -95.86 158.26 15.53 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.743 -1.117 . . . . 73.34 109.215 168.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.677 ' SG ' HG21 ' A' ' 85' ' ' ILE . 91.8 m 56.51 58.96 3.84 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 124.237 0.961 . . . . 74.44 109.934 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -70.53 -49.4 48.56 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 113.675 -1.602 . . . . 72.22 110.379 -171.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 52.4 mttm -70.58 -38.93 74.14 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.995 -174.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.27 -26.34 61.95 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.29 0.636 . . . . 74.11 111.337 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 49.7 t -69.46 -37.48 77.33 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.42 0.688 . . . . 74.54 110.311 170.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.89 -34.23 68.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.548 -0.751 . . . . 74.52 110.573 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 26' ' ' LYS . 29.0 mmt180 -69.2 -60.58 2.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.913 0.485 . . . . 73.2 109.985 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.7 tp -54.79 -49.35 71.16 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.857 0.723 . . . . 75.1 110.146 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.11 -55.48 30.09 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 124.059 0.849 . . . . 74.3 113.548 -176.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -67.94 -36.83 80.81 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.882 0.873 . . . . 74.43 110.996 -175.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.504 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 42.3 mtt-85 -63.42 -62.41 1.7 Allowed 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.822 0.701 . . . . 74.3 110.704 176.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 87.1 t -54.06 -46.76 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.041 0.936 . . . . 73.31 110.989 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.92 -38.43 90.96 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.228 -0.896 . . . . 54.54 109.708 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -75.71 -13.24 83.21 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 115.539 -0.755 . . . . 71.45 113.738 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 65.6 mt -84.09 -44.93 13.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.137 0.575 . . . . 75.24 110.003 174.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 pt -85.97 -24.43 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-N 115.498 -0.774 . . . . 71.4 112.407 -172.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -62.05 -47.28 91.1 Favored Pre-proline 0 N--CA 1.497 1.899 0 N-CA-C 112.899 0.703 . . . . 73.12 112.899 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.65 -51.48 11.02 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 121.758 1.639 . . . . 60.11 110.447 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.07 -19.61 64.89 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.296 -0.866 . . . . 52.24 111.772 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -68.1 -55.34 12.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.351 0.66 . . . . 63.2 110.013 174.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 50.7 mtm -64.65 -35.31 80.62 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.908 -1.042 . . . . 73.32 110.166 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 122' ' ' MET . 68.3 mt -82.02 -18.92 41.63 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.76 1.224 . . . . 74.32 111.838 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -75.43 -43.1 51.53 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.454 -0.572 . . . . 72.32 109.454 172.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 . . . . . 0 N--CA 1.478 0.96 0 CA-C-N 114.788 -1.096 . . . . 65.42 110.231 177.066 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 110.495 -0.187 . . . . 73.24 110.495 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.14 -34.48 68.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.193 0.597 . . . . 71.33 110.136 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -59.35 -51.49 69.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.819 0.848 . . . . 72.4 110.27 170.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.576 HD22 HD13 ' A' ' 115' ' ' LEU . 0.7 OUTLIER -54.96 -46.36 75.02 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.427 -1.26 . . . . 64.52 110.26 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 94.2 m -58.68 -46.83 86.37 Favored 'General case' 0 C--N 1.356 0.863 0 C-N-CA 124.025 0.93 . . . . 73.14 110.537 -178.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.1 m -61.88 -50.26 72.95 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.982 0.801 . . . . 71.12 110.352 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 64' ' ' ARG . . . -59.78 -40.47 88.35 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.949 0.899 . . . . 52.11 111.407 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.436 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.4 mmt -66.58 -35.59 80.59 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.481 -0.781 . . . . 75.11 110.842 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -71.7 -35.66 70.31 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.278 0.631 . . . . 62.22 111.039 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 61' ' ' ALA . 66.8 mtp85 -68.38 -41.13 81.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.072 0.949 . . . . 73.41 110.086 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.409 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 t80 -71.93 -41.2 68.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.64 -1.163 . . . . 73.25 110.023 -177.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 1.2 tmtp? -59.78 -48.35 82.02 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.092 1.357 . . . . 72.4 109.066 175.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -61.52 -40.66 95.44 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 124.538 1.149 . . . . 54.5 110.909 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.646 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -64.37 -36.1 83.04 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.698 0.799 . . . . 64.32 110.747 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -73.06 -27.69 61.88 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.282 0.633 . . . . 64.51 111.57 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 13.1 mm-40 -64.72 -41.55 95.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.338 -0.616 . . . . 75.54 109.338 172.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 5.0 mm-40 -59.48 -49.01 79.46 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-N 115.119 -0.946 . . . . 73.3 110.333 177.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.52 -47.48 85.38 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.957 0.786 . . . . 71.51 111.572 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.88 -48.75 80.3 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 124.4 1.063 . . . . 53.22 111.174 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.41 ' O ' ' HG2' ' A' ' 78' ' ' LYS . . . -61.35 -38.74 96.21 Favored Glycine 0 C--N 1.351 1.378 0 O-C-N 124.026 0.829 . . . . 31.41 112.815 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -62.89 -56.78 14.25 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 118.765 -0.636 . . . . 70.14 111.135 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.566 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.8 OUTLIER -63.49 -23.06 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 122.756 0.423 . . . . 75.23 112.053 177.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.47 -38.05 80.71 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.675 0.39 . . . . 63.32 110.262 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 74' ' ' GLY . 31.5 mmtp -83.9 -29.5 27.13 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.453 0.301 . . . . 70.44 111.129 176.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.566 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.8 m-85 -77.46 -8.52 57.88 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.319 1.048 . . . . 62.13 111.335 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.1 p -56.37 -30.41 62.64 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.214 0.606 . . . . 74.24 109.889 171.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -81.21 102.13 10.14 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.54 -1.281 . . . . 71.33 107.54 165.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.616 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.6 mpt_? -70.32 -24.89 63.09 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.749 0.82 . . . . 63.43 110.535 -175.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 72.4 p -66.89 -40.98 87.93 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.947 0.899 . . . . 44.33 110.478 172.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -57.86 -42.29 84.2 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.011 0.924 . . . . 74.12 110.65 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.677 HG21 ' SG ' ' A' ' 24' ' ' CYS . 15.7 mt -58.81 -57.45 11.16 Favored 'Isoleucine or valine' 0 C--N 1.356 0.889 0 CA-C-N 115.323 -0.853 . . . . 75.24 109.379 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.4 t -53.77 -37.09 63.08 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.766 0.827 . . . . 53.44 112.146 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -60.67 -45.71 93.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.832 1.253 . . . . 75.1 111.277 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -25.95 29.65 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.408 0.147 . . . . 70.11 110.78 176.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.464 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 13.4 tp -78.01 -29.21 49.42 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.572 0.749 . . . . 71.11 111.635 -167.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -72.76 -26.62 61.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.114 0.566 . . . . 71.41 110.214 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.13 -37.27 20.42 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.018 0.927 . . . . 74.14 110.369 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.2 p . . . . . 0 CA--C 1.543 0.682 0 C-N-CA 123.108 0.563 . . . . 63.23 110.384 -178.415 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.3 mm . . . . . 0 CA--C 1.544 0.716 0 N-CA-C 107.923 -1.139 . . . . 64.1 107.923 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.3 mp -45.33 -38.52 5.84 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.198 0.999 . . . . 63.21 112.488 -177.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.44 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 61.4 m-85 -125.65 39.31 3.99 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 123.924 0.89 . . . . 65.52 109.797 -177.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -56.55 -58.47 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.755 0.707 . . . . 74.04 111.399 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.32 -47.89 53.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.523 1.129 . . . . 72.11 110.229 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.71 -63.53 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.605 0 O-C-N 124.372 1.045 . . . . 71.15 110.933 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.426 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 43.6 t30 -65.9 -28.03 68.64 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.774 1.23 . . . . 74.11 111.475 -176.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -57.66 -46.87 83.68 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 110.02 -0.363 . . . . 74.41 110.02 169.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -67.36 -32.55 73.56 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.189 0.596 . . . . 75.41 111.944 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -60.7 -47.92 84.09 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 110.012 -0.366 . . . . 72.41 110.012 171.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.7 m -68.46 -39.67 81.34 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.048 0.939 . . . . 44.04 111.323 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.536 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 9.5 t0 -68.0 -58.41 4.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.468 -1.242 . . . . 65.44 109.151 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.5 t -65.15 -33.93 67.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.449 -0.796 . . . . 73.12 110.348 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 49.3 t-105 -60.62 -44.09 96.73 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 119.187 -0.435 . . . . 74.53 111.479 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 19.1 pttm -64.61 -43.85 92.46 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.987 -0.745 . . . . 72.02 108.987 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.7 mt-10 -61.05 -42.57 98.73 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.696 0.799 . . . . 72.12 110.747 178.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.436 HD11 ' SD ' ' A' ' 62' ' ' MET . 7.0 tt -71.41 -48.47 49.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.966 1.306 . . . . 62.3 109.785 -171.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 39.3 t -61.0 -34.66 75.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.418 1.087 . . . . 74.21 110.922 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -63.9 -58.47 6.68 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 123.043 0.537 . . . . 75.4 111.502 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.576 HD13 HD22 ' A' ' 58' ' ' LEU . 2.0 pp -67.31 -20.26 65.58 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 118.569 0.622 . . . . 63.24 112.164 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.635 HD13 ' SD ' ' A' ' 122' ' ' MET . 46.7 mt -64.01 -55.27 23.54 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.747 0.419 . . . . 72.55 110.635 167.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.22 -26.49 62.96 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.052 0.389 . . . . 74.3 112.052 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 79.3 t -78.42 -54.33 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.418 0.687 . . . . 75.43 110.517 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -90.15 -59.14 2.27 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.075 0.398 . . . . 73.23 112.075 -172.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -77.25 -14.44 59.76 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 122.721 0.408 . . . . 74.3 110.944 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.14 54.69 6.61 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.904 1.281 . . . . 63.4 108.858 -175.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.635 ' SD ' HD13 ' A' ' 116' ' ' LEU . 51.0 ttm -92.24 131.0 35.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 108.414 -0.958 . . . . 71.3 108.414 174.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 2.7 Cg_exo . . . . . 0 C--N 1.371 1.753 0 C-N-CA 122.958 2.438 . . . . 74.41 113.61 -178.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.435 ' HH2' HD21 ' A' ' 38' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.482 1.141 0 N-CA-C 111.7 0.259 . . . . 73.33 111.7 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.11 -41.38 92.48 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.499 0.719 . . . . 72.33 111.216 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.457 ' HA ' HE21 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -72.03 -45.14 61.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.897 0.879 . . . . 71.5 111.464 -178.581 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.441 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 19.0 mm-40 -50.1 -55.95 12.85 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.656 1.182 . . . . 64.12 111.449 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 -52.18 45.84 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 114.467 -1.242 . . . . 72.44 111.979 -174.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.74 -40.08 91.06 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 118.247 0.476 . . . . 74.42 111.289 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -53.16 19.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.409 0.684 . . . . 74.25 109.237 -177.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.89 -34.87 78.73 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.911 -1.04 . . . . 63.21 110.234 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.03 -31.93 66.64 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.103 0.961 . . . . 64.42 111.215 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -65.06 -47.26 77.97 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 123.738 0.649 . . . . 65.02 110.327 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.36 -33.8 75.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.768 -0.651 . . . . 71.12 111.593 174.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.7 t0 -72.58 -41.96 65.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.231 1.012 . . . . 71.24 111.521 -178.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.464 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 26.8 ttp85 -60.76 -43.23 98.27 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 114.855 -1.066 . . . . 74.41 109.128 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 13.7 ttp-105 -66.71 -33.92 76.7 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.972 -1.013 . . . . 74.41 111.548 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.4 -27.61 66.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.452 0.301 . . . . 53.43 111.101 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -47.64 10.57 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.198 0.599 . . . . 75.32 110.653 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -80.99 -41.63 22.44 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.67 0.788 . . . . 74.02 112.43 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 49.1 ttm -76.73 -61.0 2.11 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.515 -1.291 . . . . 74.34 107.515 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 18.5 tp . . . . . 0 N--CA 1.487 1.398 0 C-N-CA 124.705 1.202 . . . . 75.24 112.207 175.272 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 108.2 -1.037 . . . . 75.01 108.2 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.549 ' HA ' ' HD2' ' A' ' 66' ' ' LYS . 5.1 p30 -55.76 -43.99 77.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.471 -1.24 . . . . 61.52 111.14 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.455 ' O ' HG12 ' A' ' 8' ' ' ILE . 29.2 mt -65.55 -33.44 75.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.529 0.731 . . . . 72.41 111.789 175.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 tmtp? -60.7 -44.92 95.97 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 107.973 -1.121 . . . . 75.24 107.973 177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -68.72 -40.14 80.08 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.858 -0.61 . . . . 74.1 111.915 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.45 HD12 HD23 ' A' ' 4' ' ' LEU . 83.9 mt -58.9 -53.14 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.394 0.678 . . . . 51.33 110.612 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.756 HG23 ' HG2' ' A' ' 43' ' ' GLU . 30.6 mm -70.29 -53.68 22.0 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-N 115.413 -0.812 . . . . 71.04 110.806 -174.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 92.1 m -60.41 -58.96 6.27 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 123.834 0.709 . . . . 72.32 110.848 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 14' ' ' ILE . 95.0 mt -66.48 -32.41 73.76 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 118.644 -0.693 . . . . 73.5 111.748 -175.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -63.09 -43.01 99.39 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 121.387 -0.435 . . . . 65.31 112.473 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.02 -38.77 79.39 Favored 'General case' 0 CA--C 1.552 1.026 0 O-C-N 122.427 -0.455 . . . . 72.04 110.647 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.5 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 73.0 t -64.32 -34.85 71.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.554 0.742 . . . . 72.01 110.386 175.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.472 HG21 HG21 ' A' ' 35' ' ' VAL . 54.8 mt -56.85 -52.81 50.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.669 0.787 . . . . 71.32 109.152 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -58.96 -33.05 70.19 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 123.998 0.811 . . . . 74.12 111.522 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -67.48 -57.65 6.15 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.549 0.739 . . . . 55.2 112.023 176.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 15.0 ptp180 -82.53 -15.55 51.96 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 113.015 0.746 . . . . 75.13 113.015 -172.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.605 ' SG ' HD23 ' A' ' 31' ' ' LEU . 49.2 t -68.98 -28.37 66.55 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.097 0.408 . . . . 72.11 111.967 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -5.26 58.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.458 0.303 . . . . 65.14 111.71 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.86 -39.43 89.12 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 123.412 0.685 . . . . 53.11 109.608 172.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 80' ' ' SER . 3.3 mpp? -64.7 104.29 0.8 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.389 -0.823 . . . . 75.51 109.658 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -31.78 71.15 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.526 0.73 . . . . 75.55 109.398 172.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.483 ' O ' ' HB3' ' A' ' 21' ' ' MET . 87.2 m-85 -91.89 169.68 10.48 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.577 -1.192 . . . . 74.51 109.017 170.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.648 ' SG ' HG21 ' A' ' 85' ' ' ILE . 56.7 m 56.41 56.24 5.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.255 1.026 . . . . 63.53 110.204 -172.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.87 -47.13 66.68 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.564 -1.653 . . . . 73.12 109.961 -174.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.563 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.1 mtpm? -82.0 -17.72 45.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.889 -1.05 . . . . 74.52 109.824 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.667 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 10.7 mm-40 -70.62 -38.82 73.98 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 110.324 -0.25 . . . . 73.14 110.324 168.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.546 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 52.5 t -67.52 -32.92 74.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.843 0.715 . . . . 70.41 110.041 174.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -62.44 -62.98 1.38 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.772 0.429 . . . . 74.32 111.854 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.408 HH12 ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -60.6 -41.21 94.29 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.627 0.371 . . . . 75.44 111.875 -176.662 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.605 HD23 ' SG ' ' A' ' 18' ' ' CYS . 60.1 tp -65.24 -59.61 3.88 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.586 0.354 . . . . 60.42 110.074 179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.48 -40.77 92.77 Favored Glycine 0 C--N 1.345 1.046 0 O-C-N 124.41 1.068 . . . . 70.51 113.459 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -65.69 -49.34 68.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.522 0.729 . . . . 55.44 111.102 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.547 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 55.3 mtt-85 -57.09 -58.41 8.31 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.859 0.725 . . . . 62.52 110.147 175.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.472 HG21 HG21 ' A' ' 14' ' ' ILE . 54.5 t -52.1 -45.99 42.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 124.048 0.939 . . . . 72.21 111.672 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.18 -45.75 93.32 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.438 0.461 . . . . 72.41 110.878 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.51 -24.45 69.4 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 123.164 0.29 . . . . 63.02 113.647 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.624 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 30.2 mt -85.86 -51.6 6.29 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 123.488 0.715 . . . . 73.54 111.401 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.441 HG21 ' HA3' ' A' ' 11' ' ' GLY . 17.0 pt -72.66 -40.81 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.422 -0.799 . . . . 74.25 111.214 -173.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 23.8 tptm -51.33 -50.54 75.53 Favored Pre-proline 0 N--CA 1.49 1.571 0 N-CA-C 113.778 1.029 . . . . 72.52 113.778 -170.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 51.0 Cg_exo -57.48 -41.57 70.49 Favored 'Trans proline' 0 C--N 1.387 2.595 0 C-N-CA 121.726 1.617 . . . . 62.34 112.569 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.98 -25.51 59.97 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.185 -0.916 . . . . 64.45 111.218 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.756 ' HG2' HG23 ' A' ' 8' ' ' ILE . 38.5 mt-10 -67.69 -44.03 78.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.034 0.934 . . . . 73.32 109.562 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.3 mmt -59.69 -47.35 85.97 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 124.701 1.25 . . . . 64.45 110.165 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.2 -30.92 63.85 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.716 0.806 . . . . 54.45 112.071 -177.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.53 -29.86 61.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.94 0.896 . . . . 74.25 109.679 177.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 . . . . . 0 N--CA 1.482 1.125 0 C-N-CA 123.623 0.769 . . . . 74.35 109.94 -179.94 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p . . . . . 0 CA--C 1.541 0.611 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.13 -43.39 98.54 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.335 0.654 . . . . 74.11 110.485 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? -74.77 -21.97 59.03 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.831 -0.622 . . . . 73.33 112.147 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 115' ' ' LEU . 13.0 tp -81.22 -30.69 34.17 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.29 0.636 . . . . 72.21 110.316 174.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.8 m -63.45 -45.35 91.29 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.435 -0.95 . . . . 52.22 108.435 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.467 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 57.2 m -60.58 -44.25 96.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 124.401 1.063 . . . . 71.03 111.244 174.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.51 -42.99 98.46 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.6 0.76 . . . . 51.14 111.275 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.45 -30.67 69.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.164 0.586 . . . . 62.04 111.042 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -74.15 -32.92 63.33 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.133 0.573 . . . . 64.42 111.164 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.8 mtt180 -65.21 -47.1 78.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 109.143 -0.688 . . . . 73.33 109.143 175.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.624 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 4.5 t80 -65.51 -45.49 83.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.673 -1.603 . . . . 75.41 109.772 -175.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 34.4 tttm -49.67 -57.71 6.7 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 113.915 -1.493 . . . . 75.22 110.269 169.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -62.91 -31.47 72.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.704 0.802 . . . . 70.41 111.824 -176.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.589 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -70.0 -37.75 75.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.911 0.884 . . . . 73.21 111.164 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.03 -21.14 40.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.152 0.581 . . . . 75.52 110.541 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 78.1 mt-10 -72.55 -38.13 68.07 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.352 0.661 . . . . 61.13 110.05 171.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 48.3 mt-10 -64.67 -50.21 67.94 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.696 -0.684 . . . . 73.54 109.381 174.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -57.07 -48.18 79.2 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.279 0.987 . . . . 72.13 111.71 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -56.54 -42.73 78.98 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.436 1.085 . . . . 73.41 110.704 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.24 -36.49 89.84 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.646 0.592 . . . . 64.21 113.218 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.2 mm-40 -63.08 -55.51 24.83 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.941 -0.392 . . . . 71.32 109.941 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.3 pt -69.03 -20.18 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.366 0.666 . . . . 72.32 112.404 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -62.06 -46.66 88.15 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 122.973 0.509 . . . . 72.33 109.92 167.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -82.84 -24.33 33.35 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.349 0.5 . . . . 64.52 112.349 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.629 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.0 m-85 -81.18 -12.3 59.22 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.543 0.737 . . . . 74.42 111.239 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.611 ' HA ' ' SD ' ' A' ' 21' ' ' MET . 96.9 p -55.78 -28.71 57.49 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.669 0.606 . . . . 54.21 110.568 176.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.74 104.82 13.26 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.406 -1.331 . . . . 72.21 107.406 162.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -69.67 -23.73 63.5 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.728 0.811 . . . . 71.44 110.3 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -63.34 -35.87 81.81 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.16 -0.927 . . . . 74.5 111.884 174.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -58.55 -46.37 87.0 Favored 'General case' 0 C--O 1.256 1.44 0 C-N-CA 124.262 1.025 . . . . 75.53 109.795 175.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.648 HG21 ' SG ' ' A' ' 24' ' ' CYS . 30.7 mt -56.12 -57.43 8.56 Favored 'Isoleucine or valine' 0 C--N 1.356 0.877 0 CA-C-N 115.229 -0.896 . . . . 73.11 109.766 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.2 t -56.53 -34.9 67.48 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.358 1.036 . . . . 25.34 111.504 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -66.06 -45.37 81.57 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.529 0.732 . . . . 64.54 111.702 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.39 -22.81 32.64 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 121.122 -0.231 . . . . 74.41 110.418 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 tp -79.19 -29.44 42.9 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.934 0.894 . . . . 73.53 111.259 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -72.1 -17.2 62.0 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.84 -0.618 . . . . 61.32 110.873 176.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -121.49 16.43 11.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.66 1.184 . . . . 42.12 111.002 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 C--N 1.354 0.791 0 N-CA-C 109.55 -0.537 . . . . 64.32 109.55 179.735 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 96' ' ' ILE . 2.8 mp . . . . . 0 C--O 1.241 0.61 0 N-CA-C 109.561 -0.533 . . . . 63.22 109.561 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.667 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 5.8 tp -68.14 -41.99 80.78 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.034 0.933 . . . . 72.33 110.849 -175.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.438 ' CD1' ' HB3' ' A' ' 97' ' ' LEU . 69.8 m-85 -106.49 36.86 2.47 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 114.046 -1.434 . . . . 75.25 109.889 -175.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.61 -58.52 5.63 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.78 0.832 . . . . 74.52 112.781 -175.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.7 -49.84 69.29 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.393 -0.821 . . . . 74.42 111.219 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.79 -43.69 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 123.4 0.68 . . . . 75.24 111.006 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.492 HD21 ' NH1' ' A' ' 34' ' ' ARG . 33.0 t30 -71.16 -28.05 63.98 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.193 0.997 . . . . 72.34 110.516 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.39 -35.03 79.72 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.845 -0.798 . . . . 74.13 108.845 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -64.55 -53.48 47.17 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 109.796 -0.446 . . . . 73.32 109.796 168.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.589 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.7 mp -52.07 -38.45 57.19 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.034 0.534 . . . . 70.45 111.348 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.0 t -74.48 -56.62 4.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.326 0.65 . . . . 71.22 110.471 -175.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -53.9 -55.21 28.98 Favored 'General case' 0 C--O 1.257 1.466 0 C-N-CA 124.547 1.139 . . . . 71.44 110.715 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.2 t -65.62 -50.26 72.69 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 CA-C-N 113.547 -1.661 . . . . 60.1 110.84 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.54 -37.39 85.93 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 118.687 0.676 . . . . 72.22 111.478 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -56.69 -60.3 3.76 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.541 0.525 . . . . 64.51 109.764 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.45 -42.29 70.43 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 124.028 0.83 . . . . 73.32 111.315 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.01 -58.48 4.85 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.192 1.397 . . . . 74.35 110.156 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.2 p -59.09 -41.16 87.41 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.594 0.757 . . . . 63.43 111.602 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.19 -46.29 84.57 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.094 0.557 . . . . 72.1 112.286 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.822 HD11 HD13 ' A' ' 58' ' ' LEU . 4.2 pp -72.4 -22.94 61.05 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 122.271 -0.268 . . . . 64.15 110.706 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 122' ' ' MET . 88.1 mt -72.79 -36.01 67.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.402 0.681 . . . . 71.43 110.616 171.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -38.72 86.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 75.45 109.756 171.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 97.2 t -68.99 -60.49 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.085 0 C-N-CA 123.53 0.732 . . . . 61.34 111.558 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.16 -60.93 2.16 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.622 0.769 . . . . 70.15 111.358 -172.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -93.63 -2.63 53.81 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 114.935 -1.03 . . . . 62.41 111.2 -166.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.34 15.78 7.96 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.307 1.043 . . . . 73.21 110.72 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.556 ' SD ' HD13 ' A' ' 116' ' ' LEU . 40.2 ttm -66.61 116.84 38.59 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 123.814 0.846 . . . . 55.35 110.334 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 C--N 1.373 1.855 0 C-N-CA 123.315 2.677 . . . . 65.52 113.231 -168.27 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 12.2 m0 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 113.006 0.743 . . . . 65.52 113.006 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.0 -48.95 41.04 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-O 120.821 0.343 . . . . 74.2 110.828 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -70.05 -35.85 74.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.471 -0.786 . . . . 75.2 112.019 -178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -60.67 -49.14 78.7 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.409 0.683 . . . . 73.44 111.191 -177.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -73.93 -39.78 63.57 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.731 -0.668 . . . . 72.33 112.011 -175.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -58.28 -59.0 6.0 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.618 -0.512 . . . . 73.14 109.618 176.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -52.7 -61.75 2.09 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 124.603 1.189 . . . . 54.14 111.095 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -50.74 65.16 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.077 -0.965 . . . . 74.45 111.489 -168.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.467 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -73.17 -28.9 62.48 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.813 0.696 . . . . 25.04 112.507 -172.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.18 -47.09 68.88 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.784 -0.45 . . . . 71.43 109.784 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.43 -37.06 85.83 Favored 'General case' 0 N--CA 1.484 1.25 0 O-C-N 123.915 0.759 . . . . 75.42 111.828 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 25.4 t0 -78.36 -42.92 29.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.94 0.896 . . . . 43.33 110.923 -171.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -63.6 -40.62 97.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 108.338 -0.986 . . . . 71.11 108.338 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -60.0 -46.89 88.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.043 0.937 . . . . 71.24 110.859 175.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.38 -23.22 60.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.343 0.657 . . . . 74.21 111.632 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.448 ' HE2' ' HG ' ' A' ' 24' ' ' CYS . 0.8 OUTLIER -73.04 -57.13 4.25 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.171 0.588 . . . . 65.33 109.462 178.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -74.33 -47.29 35.48 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.341 -0.845 . . . . 74.03 110.599 -173.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 38.5 ttm -89.35 73.46 7.96 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 107.151 -1.425 . . . . 74.42 107.151 168.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 17.5 tp . . . . . 0 CA--C 1.545 0.754 0 CA-C-N 115.069 -0.969 . . . . 72.02 109.8 -177.773 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 112.167 0.432 . . . . 72.12 112.167 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -48.58 -45.17 37.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.027 1.331 . . . . 64.34 109.997 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.9 mt -57.37 -43.25 83.41 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.747 -1.115 . . . . 64.13 111.949 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -59.13 -46.68 87.73 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.565 0.541 . . . . 71.12 110.16 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -62.6 -43.55 98.53 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.927 -0.578 . . . . 62.42 111.618 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.78 -48.77 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 124.3 1.04 . . . . 73.24 110.96 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.7 mt -62.68 -42.25 95.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 CA-C-N 114.602 -1.181 . . . . 75.44 111.151 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 13' ' ' VAL . 96.5 m -61.02 -50.56 72.87 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.368 0.667 . . . . 70.41 110.252 178.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.2 -42.23 94.64 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.6 0.76 . . . . 71.24 111.019 -177.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.12 99.7 Favored Glycine 0 C--N 1.349 1.254 0 O-C-N 123.618 0.574 . . . . 60.43 112.887 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.35 -43.03 92.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 122.268 0.227 . . . . 54.43 111.242 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 9' ' ' THR . 86.2 t -61.71 -35.32 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.637 0.775 . . . . 73.34 110.526 177.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -59.88 -61.02 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.326 1.05 . . . . 70.2 110.439 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.9 -33.12 73.65 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 123.644 0.59 . . . . 74.41 111.187 -175.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -62.21 -60.73 3.16 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.267 1.027 . . . . 72.0 110.825 177.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -78.57 -17.18 56.51 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.134 0.573 . . . . 73.44 112.514 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.5 t -60.95 -16.75 46.25 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.22 1.008 . . . . 61.52 111.49 175.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -58.39 -16.27 14.05 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.61 0.764 . . . . 71.54 112.685 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -62.3 -30.73 71.35 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.613 0.765 . . . . 74.25 111.818 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.5 mmt -67.85 90.38 0.29 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 120.909 0.385 . . . . 63.52 110.264 -175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.75 -49.43 53.13 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 107.806 -1.183 . . . . 73.32 107.806 173.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -93.63 -179.51 5.04 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.53 -1.668 . . . . 73.13 109.721 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.592 ' SG ' HG21 ' A' ' 85' ' ' ILE . 34.1 m 53.01 56.24 7.83 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-O 122.199 1.0 . . . . 74.22 110.008 -167.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.87 -49.83 41.83 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 113.109 -1.86 . . . . 73.15 110.624 -169.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.1 -39.77 63.16 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.807 -1.088 . . . . 73.53 108.975 -174.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -65.12 -27.01 68.44 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.31 0.644 . . . . 63.35 112.031 173.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.3 t -77.24 -35.33 55.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 122.605 0.362 . . . . 53.14 110.656 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -70.07 -33.4 71.86 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 116.412 -0.358 . . . . 61.22 110.416 172.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.488 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -67.94 -58.18 4.97 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.62 0.768 . . . . 74.14 109.822 179.699 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.97 -44.91 83.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.417 1.087 . . . . 73.4 110.359 178.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.58 -49.61 72.19 Favored Glycine 0 C--N 1.346 1.139 0 O-C-N 124.064 0.852 . . . . 41.0 112.87 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -65.9 -38.01 87.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.874 0.47 . . . . 70.32 111.399 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.436 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 83.3 mtt-85 -60.0 -53.59 56.08 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.059 0.543 . . . . 71.14 110.672 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 39' ' ' ILE . 61.9 t -59.5 -50.49 79.72 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.425 0 O-C-N 124.25 0.968 . . . . 51.34 110.846 -177.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.52 -46.49 85.79 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.6 0.563 . . . . 74.22 111.426 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.52 -19.15 74.36 Favored Glycine 0 N--CA 1.468 0.828 0 O-C-N 123.303 0.377 . . . . 53.31 113.367 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -86.64 -48.16 8.55 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.658 0.783 . . . . 64.45 111.663 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 35' ' ' VAL . 14.0 pt -79.54 -34.73 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 119.366 -0.35 . . . . 64.14 111.373 -173.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 44' ' ' MET . 87.5 tttt -57.33 -51.84 78.67 Favored Pre-proline 0 N--CA 1.488 1.449 0 N-CA-C 113.843 1.053 . . . . 73.53 113.843 -174.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.32 -31.78 93.28 Favored 'Trans proline' 0 C--N 1.386 2.542 0 C-N-CA 121.573 1.515 . . . . 51.01 112.042 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.69 -40.99 72.58 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.169 0.588 . . . . 65.31 110.52 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.64 -37.36 83.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.568 0.747 . . . . 60.24 111.016 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -59.0 -55.05 40.21 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.909 0.756 . . . . 74.32 111.173 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 pp -77.42 -33.68 54.88 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.519 -0.764 . . . . 55.52 112.355 -175.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.81 -43.54 62.58 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.311 0.644 . . . . 74.05 110.066 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 122.994 0.518 . . . . 75.44 110.377 175.894 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.6 p . . . . . 0 C--O 1.244 0.778 0 N-CA-C 109.302 -0.629 . . . . 72.41 109.302 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -58.95 -58.67 7.64 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.195 0.598 . . . . 72.43 111.044 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.9 -18.61 60.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.345 0.498 . . . . 64.15 112.345 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -65.9 -56.19 13.08 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 108.085 -1.079 . . . . 64.44 108.085 175.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 m -62.21 -39.73 93.74 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.071 -0.968 . . . . 72.12 110.824 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 88.5 m -61.44 -44.81 96.47 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.542 0.737 . . . . 73.43 111.36 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.85 86.08 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.142 0.577 . . . . 63.14 110.772 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.83 -27.82 68.53 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.746 0.654 . . . . 61.51 111.037 176.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -75.0 -41.27 59.8 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.144 0.577 . . . . 63.32 110.463 176.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 60' ' ' THR . 87.8 mtt180 -62.2 -40.55 96.44 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.31 0.576 . . . . 73.34 110.161 174.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.6 OUTLIER -65.88 -56.75 10.21 Favored 'General case' 0 C--O 1.216 -0.666 0 CA-C-N 114.422 -1.263 . . . . 75.33 109.277 -177.45 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.0 tmtt? -55.04 -41.28 71.21 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.876 1.27 . . . . 64.1 110.713 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.08 97.78 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.357 0.663 . . . . 60.42 111.296 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.544 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -67.4 -39.48 85.57 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.614 0.766 . . . . 64.22 111.156 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.422 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.4 mm? -67.02 -32.31 73.45 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.539 0.736 . . . . 74.31 111.002 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.8 mt-10 -68.08 -40.64 82.64 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.138 0.575 . . . . 72.25 111.288 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.9 mt-10 -67.92 -38.75 83.3 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.167 0.587 . . . . 72.22 110.11 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.469 ' HA ' ' HE2' ' A' ' 98' ' ' PHE . . . -64.71 -45.85 84.82 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.113 0.565 . . . . 71.35 110.603 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -59.51 -38.97 82.33 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 124.675 1.19 . . . . 63.23 110.561 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.3 -40.36 80.89 Favored Glycine 0 C--N 1.344 0.996 0 CA-C-N 114.894 -1.048 . . . . 75.52 112.472 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 24.0 mm-40 -68.07 -45.23 74.41 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.976 -0.535 . . . . 74.34 111.208 -178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.603 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.7 OUTLIER -68.02 -26.39 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 CA-C-N 118.525 0.602 . . . . 63.24 111.544 175.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.76 -35.06 79.87 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.031 0.443 . . . . 64.3 110.315 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -76.43 -38.39 55.58 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.264 0.626 . . . . 63.43 110.847 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -75.01 -7.41 53.57 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.906 0.882 . . . . 65.43 112.596 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.4 p -57.72 -33.09 68.05 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.18 0.514 . . . . 71.22 110.308 176.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.05 109.81 5.35 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 107.721 -1.214 . . . . 73.33 107.721 164.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -67.57 -30.21 69.77 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 123.563 0.745 . . . . 64.13 111.022 -170.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -72.99 -27.17 61.64 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.153 -0.93 . . . . 60.5 111.67 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -60.85 -40.98 94.96 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 123.794 0.838 . . . . 53.24 110.866 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.592 HG21 ' SG ' ' A' ' 24' ' ' CYS . 16.0 mt -61.06 -55.3 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.165 -0.925 . . . . 74.12 109.252 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.1 -31.07 68.59 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.455 0.702 . . . . 72.55 111.607 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -63.17 -47.62 81.87 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.335 1.054 . . . . 50.44 111.321 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -29.84 43.1 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 120.243 -0.583 . . . . 72.02 110.285 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.44 ' HA ' ' HB3' ' A' ' 92' ' ' SER . 6.8 tp -74.49 -27.0 60.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.682 0.793 . . . . 44.12 111.512 -169.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -71.88 -22.1 61.56 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.947 0.499 . . . . 43.53 110.842 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.44 -35.72 13.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.901 0.88 . . . . 72.44 110.145 174.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.44 ' HB3' ' HA ' ' A' ' 89' ' ' LEU . 32.1 t . . . . . 0 N--CA 1.474 0.748 0 C-N-CA 124.116 0.967 . . . . 62.33 110.974 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 12.4 mm . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 119.274 -0.393 . . . . 73.34 110.103 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.406 HD13 ' SG ' ' A' ' 24' ' ' CYS . 5.4 tp -49.47 -40.58 37.6 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.389 0.676 . . . . 63.42 111.529 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.603 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 36.1 m-85 -124.38 42.42 3.26 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.681 -1.145 . . . . 74.34 109.993 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -49.87 -66.1 0.45 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.556 0.743 . . . . 73.14 110.461 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.18 -46.78 72.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.088 0.868 . . . . 65.12 111.293 -175.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.8 t -67.58 -55.97 15.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.582 -0.736 . . . . 72.45 111.315 -172.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.534 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 13.8 t30 -63.38 -28.41 69.97 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.999 0.92 . . . . 74.1 111.012 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -61.57 -42.85 99.45 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 110.146 -0.316 . . . . 72.22 110.146 170.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -59.45 -48.44 81.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 123.351 0.407 . . . . 74.11 110.764 173.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.544 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.0 mp -55.52 -41.63 73.39 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.537 0.335 . . . . 73.33 110.465 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.1 t -64.83 -52.92 54.13 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.151 0.98 . . . . 73.23 111.012 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.7 m-20 -65.76 -46.55 78.4 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.672 0.789 . . . . 75.23 111.787 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 85.2 t -66.99 -35.9 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 122.714 0.406 . . . . 65.31 110.545 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 21.4 t-105 -62.74 -41.57 99.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.706 0.402 . . . . 71.53 110.8 174.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtpt -56.33 -56.16 24.5 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 123.465 0.478 . . . . 75.13 109.746 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.55 -38.97 72.62 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.217 1.007 . . . . 62.41 111.331 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.0 OUTLIER -66.14 -59.62 3.59 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.237 0.961 . . . . 72.4 109.072 -173.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -59.06 -33.2 70.5 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.07 0.948 . . . . 70.51 111.195 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.468 ' O ' HG23 ' A' ' 118' ' ' VAL . 70.8 mt -60.55 -63.85 1.16 Allowed 'General case' 0 C--N 1.358 0.946 0 O-C-N 123.752 0.657 . . . . 64.24 111.193 173.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.02 -29.86 71.15 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.34 0.496 . . . . 71.23 112.34 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 88.4 mt -66.78 -45.42 78.5 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.854 0.862 . . . . 73.52 110.603 175.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 114' ' ' LEU . 2.4 pt20 -76.97 -20.29 56.27 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.079 0.152 . . . . 62.42 111.365 -179.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 114' ' ' LEU . 54.7 t -71.72 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 123.342 0.657 . . . . 65.04 110.749 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -89.96 -58.48 2.49 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.324 0.583 . . . . 74.42 111.781 -175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -77.8 -12.86 60.01 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.137 -0.938 . . . . 75.15 110.855 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.456 ' O ' ' HD3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER 64.17 18.13 11.08 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.341 1.457 . . . . 72.53 110.787 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 87.9 mtp -64.12 112.66 8.02 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.498 0.719 . . . . 71.52 110.038 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo . . . . . 0 C--N 1.375 1.929 0 C-N-CA 123.821 3.014 . . . . 71.12 110.753 -176.52 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 113.091 0.775 . . . . 72.3 113.091 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.78 -36.03 79.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.009 0.523 . . . . 52.31 111.577 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -74.75 -36.27 62.59 Favored 'General case' 0 C--O 1.257 1.452 0 C-N-CA 123.301 0.64 . . . . 64.42 110.313 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 37.7 mt-10 -58.16 -62.5 1.78 Allowed 'General case' 0 C--N 1.355 0.818 0 CA-C-N 114.338 -1.301 . . . . 75.41 109.184 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -52.57 -37.06 57.16 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.041 0.838 . . . . 74.12 112.748 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -63.4 -60.63 3.12 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.267 0.354 . . . . 73.41 110.571 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -36.33 83.75 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.456 1.122 . . . . 73.43 110.0 -176.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.67 -63.63 1.02 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 113.493 -1.685 . . . . 61.25 110.32 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 145' ' ' ARG . . . -63.83 -25.23 68.08 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 124.372 1.045 . . . . 60.32 111.564 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 17.4 t70 -60.42 -63.5 1.28 Allowed 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.526 -0.546 . . . . 72.2 109.526 175.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.8 -32.0 73.48 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 123.694 0.621 . . . . 63.22 112.116 -177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -71.65 -35.79 70.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.083 0.553 . . . . 74.03 110.644 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 141' ' ' ALA . 3.9 tmt_? -67.0 -39.78 87.19 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.929 0.892 . . . . 65.22 109.216 174.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 12.2 mmt180 -61.34 -48.77 79.81 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.508 0.505 . . . . 75.41 110.0 177.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.32 69.82 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.436 0.695 . . . . 63.31 111.993 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.86 -58.89 3.07 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.569 0.543 . . . . 74.22 110.275 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -75.2 -53.13 9.34 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.324 0.65 . . . . 63.22 111.313 -170.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.8 ttm -86.14 71.22 10.58 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.057 -1.46 . . . . 51.12 107.057 167.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.6 tp . . . . . 0 C--O 1.236 0.368 0 CA-C-N 115.196 -0.911 . . . . 73.04 108.901 -178.725 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 . . . . . 0 N--CA 1.481 1.11 0 CA-C-O 120.478 0.18 . . . . 74.22 111.317 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -60.86 -53.86 52.2 Favored 'General case' 0 N--CA 1.482 1.142 0 O-C-N 123.759 0.662 . . . . 61.31 109.51 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' HG12 ' A' ' 8' ' ' ILE . 52.8 mt -65.84 -36.53 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.587 -1.188 . . . . 74.03 111.29 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -58.95 -48.17 82.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.542 -0.91 . . . . 72.41 108.542 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -70.21 -42.29 72.51 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-N 115.923 -0.58 . . . . 72.01 111.961 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.4 mt -56.62 -46.26 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.265 0.555 . . . . 62.24 110.892 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 4' ' ' LEU . 35.3 mm -72.72 -42.32 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.397 -0.819 . . . . 64.35 111.023 -176.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' HG23 ' A' ' 13' ' ' VAL . 86.6 m -64.34 -53.99 39.96 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.351 0.261 . . . . 73.11 110.453 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.9 mt -57.02 -51.5 69.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.925 0.89 . . . . 53.13 111.263 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.426 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -64.59 -32.04 82.88 Favored Glycine 0 C--N 1.344 1.021 0 O-C-N 123.907 0.755 . . . . 51.24 113.714 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.5 -44.99 56.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 122.689 -0.301 . . . . 74.34 110.632 176.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 75.3 t -59.31 -35.89 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.309 0.643 . . . . 75.22 109.893 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.573 HG21 HG21 ' A' ' 35' ' ' VAL . 29.6 mt -57.5 -54.36 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.464 1.105 . . . . 72.12 109.882 171.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -53.85 -34.93 60.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.941 0.896 . . . . 64.34 111.463 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -77.45 -47.22 20.27 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 112.266 0.469 . . . . 73.11 112.266 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.3 ptp180 -83.76 -17.24 41.83 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 112.851 0.686 . . . . 72.31 112.851 -173.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.08 -24.87 67.58 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.035 0.534 . . . . 53.15 111.671 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.8 -7.16 49.36 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.146 0.424 . . . . 74.54 112.146 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -61.14 -21.6 63.9 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.485 0.714 . . . . 74.01 111.612 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 21.6 mmt -67.78 88.57 0.25 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 124.013 0.821 . . . . 74.51 109.891 176.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.478 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 0.2 OUTLIER -69.93 -30.73 68.19 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.462 0.649 . . . . 71.24 109.901 170.343 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' MET . 53.0 m-85 -106.44 172.87 6.58 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.256 1.022 . . . . 74.52 108.472 167.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.548 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 66.4 m 58.95 73.91 0.46 Allowed 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.456 0.646 . . . . 75.34 110.705 -170.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.99 -59.49 2.88 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.715 1.206 . . . . 73.3 110.665 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 45.8 mmtm -68.33 -29.07 67.73 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 114.439 -1.255 . . . . 71.33 110.323 -175.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.433 ' HG2' ' CB ' ' A' ' 97' ' ' LEU . 0.3 OUTLIER -71.88 -40.18 69.11 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 123.611 0.569 . . . . 64.14 111.562 177.275 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.53 -41.32 97.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.315 0.578 . . . . 75.35 109.831 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -77.27 -24.14 51.08 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.093 -0.958 . . . . 63.2 111.487 176.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 137' ' ' ASP . 0.1 OUTLIER -70.13 -57.82 4.51 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 122.077 0.941 . . . . 74.11 109.803 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.94 -44.97 91.21 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.115 -1.857 . . . . 75.11 108.86 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.58 -53.2 48.0 Favored Glycine 0 C--N 1.353 1.477 0 O-C-N 123.877 0.736 . . . . 63.34 113.625 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -63.29 -45.44 91.43 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.219 0.607 . . . . 72.4 111.342 -175.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.616 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.6 mtt-85 -58.35 -58.03 10.31 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 123.763 0.664 . . . . 73.13 110.913 178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 14' ' ' ILE . 79.2 t -56.94 -40.21 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.564 0.54 . . . . 75.52 111.358 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.411 HD23 HD11 ' A' ' 39' ' ' ILE . 71.7 mt -61.32 -48.39 81.56 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.589 0.356 . . . . 74.42 111.765 174.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.14 -21.44 61.68 Favored Glycine 0 N--CA 1.47 0.956 0 CA-C-N 116.613 -0.267 . . . . 74.23 113.202 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 61.7 mt -87.02 -52.19 5.58 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.383 0.673 . . . . 73.25 112.442 175.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 24.1 pt -74.23 -42.74 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 118.63 -0.7 . . . . 62.11 111.766 -169.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' MET . 53.2 mtmt -56.43 -51.49 80.59 Favored Pre-proline 0 N--CA 1.489 1.483 0 CA-C-O 118.071 -0.966 . . . . 70.51 112.786 -173.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 40' ' ' LYS . 77.8 Cg_exo -51.89 -45.64 37.25 Favored 'Trans proline' 0 C--N 1.4 3.249 0 C-N-CA 122.295 1.997 . . . . 75.02 112.334 174.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.464 HD13 HD21 ' A' ' 45' ' ' LEU . 4.5 mm? -66.39 -33.03 74.79 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.017 -0.992 . . . . 52.42 111.563 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 49.7 mt-10 -70.55 -35.17 72.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.403 0.681 . . . . 63.22 110.401 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -67.93 -47.13 69.57 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.477 0.485 . . . . 65.22 110.498 -178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.464 HD21 HD13 ' A' ' 42' ' ' LEU . 4.2 pp -75.16 -30.87 60.87 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.744 0.418 . . . . 62.4 111.739 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -70.87 -35.43 72.37 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.325 0.65 . . . . 72.52 110.703 175.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 . . . . . 0 N--CA 1.483 1.191 0 C-N-CA 123.177 0.591 . . . . 61.31 110.715 -178.741 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.479 1.024 0 N-CA-C 110.119 -0.326 . . . . 74.33 110.119 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.8 -57.05 13.34 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.078 0.951 . . . . 72.34 111.55 -174.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -70.81 -23.64 62.4 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.816 0.446 . . . . 63.45 111.787 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -48.29 73.27 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.273 -1.01 . . . . 71.23 108.273 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 43.3 m -68.41 -41.73 80.0 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.947 -1.024 . . . . 74.54 111.066 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 62.4 m -61.27 -40.53 94.44 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.307 0.643 . . . . 53.34 110.704 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.556 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -64.4 -44.69 90.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.98 0.512 . . . . 74.23 110.454 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.9 mmt -64.0 -25.86 68.32 Favored 'General case' 0 CA--C 1.558 1.278 0 O-C-N 123.92 0.763 . . . . 73.12 111.844 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -77.14 -44.75 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.843 0.857 . . . . 71.23 110.772 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.5 mtp85 -61.12 -40.6 94.37 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.042 0.937 . . . . 75.12 109.393 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -67.92 -51.61 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 114.099 -1.409 . . . . 75.3 110.002 -177.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 14.5 tmtt? -54.97 -47.95 73.88 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.933 1.293 . . . . 75.04 110.999 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -65.25 -40.7 94.35 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.687 0.617 . . . . 60.14 111.407 -178.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.54 -41.57 98.44 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.21 0.604 . . . . 51.14 111.248 177.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 14' ' ' ILE . 11.0 mp -65.11 -32.17 73.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.335 0.654 . . . . 73.54 111.675 174.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 50.2 mt-10 -64.74 -40.91 96.12 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.685 0.394 . . . . 64.31 110.974 174.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.418 ' HB2' HG13 ' A' ' 101' ' ' VAL . 47.8 mt-10 -62.54 -49.69 74.29 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.629 0.581 . . . . 74.31 110.031 177.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.457 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.22 -44.02 92.3 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 123.96 0.787 . . . . 63.03 111.103 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -59.92 -44.69 94.16 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.152 1.381 . . . . 74.14 110.77 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.67 -39.43 93.73 Favored Glycine 0 C--N 1.343 0.952 0 CA-C-N 114.996 -1.002 . . . . 55.5 112.32 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -59.97 -57.89 10.9 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.154 0.477 . . . . 54.45 110.302 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.457 HG12 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -63.55 -23.19 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 112.659 0.614 . . . . 75.24 112.659 177.453 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.406 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 33.4 tt0 -65.16 -44.64 87.9 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.584 0.354 . . . . 73.32 110.921 173.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -87.82 -19.11 27.91 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.513 0.325 . . . . 64.24 111.288 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 11.5 m-30 -82.0 0.84 38.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.43 0.692 . . . . 75.11 111.578 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 74.1 p -57.47 -24.9 58.46 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.316 0.646 . . . . 72.15 110.668 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -85.35 95.59 9.28 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 108.224 -1.028 . . . . 71.54 108.224 168.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.543 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -73.13 -31.63 64.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.715 0.806 . . . . 53.54 112.064 -169.434 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.8 p -74.11 -32.89 63.39 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.978 0.511 . . . . 72.33 110.803 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -66.43 -32.91 74.58 Favored 'General case' 0 C--O 1.249 1.06 0 C-N-CA 123.756 0.822 . . . . 70.42 109.964 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 36.9 mt -55.88 -53.05 42.38 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 109.017 -0.734 . . . . 73.51 109.017 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 148' ' ' PHE . 42.8 t -57.05 -39.35 74.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.909 0.884 . . . . 62.14 111.747 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -58.68 -51.24 70.78 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 114.994 -1.003 . . . . 64.11 110.891 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.41 -23.14 50.67 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.677 0.391 . . . . 63.34 110.831 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -72.21 -47.18 52.47 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.974 0.91 . . . . 74.43 110.506 -172.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -63.12 -29.04 70.48 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.838 -0.619 . . . . 63.33 110.415 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.41 61.03 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.59 0.756 . . . . 71.02 111.029 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 t . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 123.757 0.823 . . . . 73.31 109.899 179.591 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.434 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 2.5 mp . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 107.45 -1.315 . . . . 72.41 107.45 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.433 ' CB ' ' HG2' ' A' ' 27' ' ' GLN . 13.5 tp -69.57 -32.85 71.86 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.44 0.638 . . . . 63.22 111.157 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -109.21 16.76 22.22 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 115.033 -0.985 . . . . 74.2 111.669 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 85.6 tttt -42.54 -57.35 2.7 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.96 1.467 . . . . 74.33 114.96 -163.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.67 -48.7 65.89 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.906 0.882 . . . . 74.33 111.255 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.2 t -61.72 -52.72 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.948 0.899 . . . . 73.44 110.978 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -68.35 -26.32 65.53 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.873 1.269 . . . . 72.35 110.712 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.438 ' NH1' ' HB2' ' A' ' 107' ' ' ASP . 15.3 tpt180 -61.35 -43.59 98.61 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.446 0.699 . . . . 71.05 109.845 168.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -60.26 -49.77 76.29 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 119.046 -0.502 . . . . 61.11 111.577 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.497 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.8 mp -55.33 -37.84 67.96 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-N 118.607 0.639 . . . . 62.22 111.261 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.616 ' HB2' HH12 ' A' ' 34' ' ' ARG . 32.9 t -67.13 -53.03 34.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.804 0.842 . . . . 63.22 111.12 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.576 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 5.7 t70 -78.43 -29.23 46.95 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.745 -0.661 . . . . 74.21 111.146 -170.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 70.3 t -79.46 -27.38 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.947 0.499 . . . . 73.51 110.165 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 20.2 t-105 -65.45 -39.73 92.37 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 118.717 0.69 . . . . 73.51 110.21 168.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.576 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 49.2 mtpt -54.92 -59.05 5.27 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 123.494 0.496 . . . . 73.41 109.793 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 50.0 mt-10 -53.45 -47.96 69.26 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.523 1.14 . . . . 51.13 110.568 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 2.6 tp -57.91 -59.66 4.9 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.382 1.073 . . . . 63.24 109.592 -173.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.3 t -55.08 -41.41 71.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.675 1.19 . . . . 64.05 112.103 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.41 -47.21 67.87 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.074 -0.512 . . . . 73.43 111.996 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.556 HD21 ' HB2' ' A' ' 61' ' ' ALA . 4.2 pp -78.4 -19.29 53.6 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.818 -0.551 . . . . 72.02 111.43 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.468 ' HG ' ' HE2' ' A' ' 122' ' ' MET . 2.0 mp -63.46 -53.36 53.31 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.923 -0.769 . . . . 65.11 108.923 169.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -72.18 -27.69 62.72 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.651 0.38 . . . . 73.05 112.024 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.93 -63.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.852 0.461 . . . . 62.31 110.956 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -85.36 -58.23 2.76 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.486 0.715 . . . . 74.53 111.484 -165.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -88.55 -2.97 58.89 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.284 0.634 . . . . 75.25 110.318 -176.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 54.85 35.85 25.21 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.73 1.612 . . . . 35.12 112.363 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.468 ' HE2' ' HG ' ' A' ' 116' ' ' LEU . 27.7 mtm -95.66 129.3 34.97 Favored Pre-proline 0 N--CA 1.477 0.917 0 O-C-N 121.669 -0.644 . . . . 63.12 110.336 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo . . . . . 0 C--N 1.37 1.698 0 C-N-CA 123.523 2.815 . . . . 53.13 112.11 -175.59 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 22.0 m0 . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 113.753 1.02 . . . . 73.31 113.753 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.77 -25.26 48.94 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 120.796 0.331 . . . . 71.55 111.557 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -89.71 -50.83 5.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.738 0.815 . . . . 62.45 111.126 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 133' ' ' TRP . 11.5 pt-20 -57.05 -42.33 80.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.528 0.731 . . . . 42.44 111.754 -174.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.0 OUTLIER -60.09 -51.26 70.36 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.152 0.581 . . . . 63.32 112.012 -177.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.42 -39.27 77.97 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.219 0.324 . . . . 54.34 111.515 -175.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -66.99 -57.91 5.97 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.642 0.734 . . . . 50.51 111.3 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.614 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 1.2 m-20 -55.53 -51.92 65.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.194 -1.366 . . . . 73.4 111.119 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -66.93 -27.26 67.34 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.286 0.476 . . . . 73.31 112.286 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -58.83 -58.45 8.58 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.102 -0.703 . . . . 74.03 109.102 172.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.58 -25.15 65.63 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.802 -1.544 . . . . 62.32 111.609 -177.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.431 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.2 t0 -84.51 -42.26 15.71 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.634 0.774 . . . . 75.43 111.898 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.751 0.82 . . . . 74.01 109.13 170.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -61.79 -43.96 97.82 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.409 -1.269 . . . . 73.5 110.773 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.1 -18.08 60.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.331 0.653 . . . . 71.04 112.325 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.548 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.5 OUTLIER -78.42 -60.81 2.22 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.967 -0.753 . . . . 73.22 108.967 176.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -73.73 -51.27 17.08 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.803 -1.09 . . . . 70.43 110.866 -171.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 28.4 mmt -101.82 51.74 0.83 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.065 -0.716 . . . . 73.13 109.065 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.8 tt . . . . . 0 N--CA 1.475 0.796 0 CA-C-N 115.152 -0.931 . . . . 73.32 109.443 -176.162 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 120.547 0.213 . . . . 62.32 111.247 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -67.76 -38.25 83.2 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.863 -0.608 . . . . 73.22 109.694 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' A' ' 42' ' ' LEU . 31.6 tp -69.23 -36.52 77.28 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.134 -0.939 . . . . 62.41 110.734 176.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 46' ' ' GLN . 3.2 tmtp? -63.6 -42.44 98.23 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 108.612 -0.885 . . . . 73.42 108.612 177.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -58.41 -44.74 89.14 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.291 0.994 . . . . 70.31 110.765 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.401 HD11 ' HA ' ' A' ' 62' ' ' MET . 82.1 mt -54.31 -50.94 52.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 124.191 0.996 . . . . 51.1 111.077 174.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 4' ' ' LEU . 24.9 mm -63.27 -43.71 98.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.989 0.916 . . . . 71.35 111.02 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.8 m -64.15 -48.55 75.57 Favored 'General case' 0 C--N 1.348 0.511 0 O-C-N 123.966 0.791 . . . . 74.41 110.325 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.0 -45.87 86.15 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 124.025 0.828 . . . . 73.43 110.72 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.568 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -59.97 -46.05 94.82 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 124.346 1.029 . . . . 24.3 113.027 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -63.38 -49.63 73.07 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 122.56 0.344 . . . . 64.33 110.627 178.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 84.3 t -60.84 -33.15 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.759 0.824 . . . . 73.51 110.932 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.462 HG21 HG21 ' A' ' 35' ' ' VAL . 17.3 mt -57.82 -54.68 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.179 0.992 . . . . 72.54 109.007 174.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -62.2 -31.28 71.79 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.013 0.82 . . . . 72.01 111.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.86 -59.95 3.08 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.719 0.407 . . . . 72.11 111.172 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 16.4 ptp180 -73.34 -16.56 61.36 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 112.621 0.6 . . . . 70.34 112.621 -175.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.41 ' SG ' HD23 ' A' ' 31' ' ' LEU . 46.1 t -66.72 -22.83 66.05 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.305 0.642 . . . . 43.43 110.864 173.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -76.34 2.91 12.14 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 60.31 111.836 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -86.54 -1.22 57.45 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.536 0.734 . . . . 75.04 111.978 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 15.0 mmt -80.81 95.9 6.82 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.912 0.387 . . . . 74.44 110.987 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HB3' ' HG2' ' A' ' 82' ' ' ARG . 12.1 tptt -67.97 -41.1 82.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.546 1.138 . . . . 51.3 110.014 170.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -97.17 -178.66 4.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 114.979 -1.01 . . . . 72.4 109.225 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.9 p 46.68 62.35 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.768 1.227 . . . . 71.13 111.608 175.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 22' ' ' LYS . 32.8 mmtp -73.39 -38.95 65.46 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.58 -1.191 . . . . 65.21 111.742 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 140' ' ' ASP . 58.8 tptt -63.26 -47.67 81.42 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.832 -1.174 . . . . 74.11 107.832 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.4 ' HG2' HD12 ' A' ' 97' ' ' LEU . 3.0 tp-100 -46.82 -54.37 10.01 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.848 1.659 . . . . 72.43 111.129 175.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 20.4 t -62.17 -50.78 70.47 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.725 1.21 . . . . 63.4 112.88 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -73.6 -37.75 65.33 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.207 0.603 . . . . 74.12 111.8 -171.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -81.15 -28.13 35.19 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.304 0.377 . . . . 74.41 110.066 -178.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.41 HD23 ' SG ' ' A' ' 18' ' ' CYS . 69.2 tp -62.26 -51.13 68.98 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 108.262 -1.014 . . . . 65.22 108.262 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.1 -36.2 91.98 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 124.152 0.908 . . . . 60.51 113.089 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -64.49 -53.92 40.61 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 124.031 0.933 . . . . 64.43 110.348 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -46.9 -60.69 2.27 Favored 'General case' 0 C--N 1.367 1.362 0 O-C-N 124.992 1.433 . . . . 54.23 109.282 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.462 HG21 HG21 ' A' ' 14' ' ' ILE . 48.2 t -57.64 -48.1 84.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 125.182 1.393 . . . . 74.53 112.596 -171.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.5 mt -65.48 -50.13 66.46 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 118.442 0.565 . . . . 61.33 110.726 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.12 -19.66 66.25 Favored Glycine 0 C--N 1.351 1.405 0 O-C-N 123.78 0.675 . . . . 60.22 112.752 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.554 HD11 ' HZ ' ' A' ' 65' ' ' PHE . 19.2 tp -84.46 -50.32 7.86 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.571 1.148 . . . . 73.43 111.974 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.568 HG21 ' HA3' ' A' ' 11' ' ' GLY . 10.1 pt -79.21 -30.95 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.1 0.56 . . . . 63.41 111.221 -171.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 15.4 tppt? -58.68 -53.98 60.85 Favored Pre-proline 0 CA--C 1.567 1.608 0 CA-C-O 118.031 -0.985 . . . . 71.41 113.033 -174.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -61.17 -31.09 89.8 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 121.613 1.542 . . . . 75.03 112.303 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 4' ' ' LEU . 4.3 mm? -78.03 -36.55 48.45 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.448 0.699 . . . . 74.03 111.24 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 12.0 pt-20 -77.79 -20.34 53.47 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 119.192 -0.432 . . . . 65.51 111.574 -177.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.0 mmt -60.53 -56.31 22.87 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.45 0.469 . . . . 64.02 110.681 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 pp -72.64 -30.83 64.64 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.1 0.56 . . . . 75.21 111.437 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.525 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.0 OUTLIER -64.03 -44.61 92.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.507 0.723 . . . . 73.24 111.051 175.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.4 t70 . . . . . 0 N--CA 1.485 1.32 0 C-N-CA 123.864 0.866 . . . . 71.24 111.121 -178.452 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.1 m . . . . . 0 CA--C 1.554 1.131 0 N-CA-C 111.79 0.293 . . . . 71.3 111.79 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -62.67 -37.91 88.26 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.822 0.449 . . . . 72.24 111.011 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -67.49 -31.6 71.85 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.334 0.654 . . . . 72.54 111.031 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.09 -50.74 63.02 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.105 0.562 . . . . 75.42 109.522 174.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 m -58.39 -48.68 79.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.174 0.99 . . . . 72.11 111.228 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -61.76 -43.97 97.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.057 0.943 . . . . 75.45 110.671 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.54 98.82 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.857 0.723 . . . . 73.25 110.928 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.406 ' SD ' ' HB2' ' A' ' 4' ' ' LEU . 31.2 mmt -64.38 -43.03 95.75 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.507 0.723 . . . . 62.41 110.694 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.6 -39.57 88.46 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 124.004 0.922 . . . . 72.15 111.3 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.423 ' HE ' HG22 ' A' ' 108' ' ' VAL . 49.7 ttt85 -72.34 -38.07 68.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.583 1.553 . . . . 75.31 111.002 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.554 ' HZ ' HD11 ' A' ' 38' ' ' LEU . 2.4 t80 -73.87 -43.77 57.52 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.896 -1.047 . . . . 63.41 109.515 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.0 ttpp -55.97 -47.42 77.69 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 114.288 -1.323 . . . . 61.35 109.925 172.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.87 92.2 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.826 0.85 . . . . 74.41 111.643 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.584 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.02 -42.3 98.2 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 115.421 -0.809 . . . . 74.43 110.978 175.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.02 -26.7 62.32 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.378 0.671 . . . . 72.43 111.852 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 97.8 mt-10 -65.58 -43.81 88.6 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 108.664 -0.865 . . . . 75.44 108.664 175.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 50.8 mt-10 -61.03 -52.69 63.92 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.741 -1.118 . . . . 70.34 110.365 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.91 -45.99 82.26 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 124.085 0.866 . . . . 71.55 111.454 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.08 -36.04 80.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.513 1.125 . . . . 71.5 110.28 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 77' ' ' GLU . . . -69.38 -36.02 77.22 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.289 -0.869 . . . . 72.02 112.881 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 14.4 mm-40 -65.33 -55.41 18.38 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.528 0.664 . . . . 73.03 110.041 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.521 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.2 pt -64.2 -27.06 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 112.581 0.586 . . . . 65.54 112.581 176.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.443 ' HB3' ' O ' ' A' ' 74' ' ' GLY . 11.3 tt0 -56.39 -49.13 75.36 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.957 0.503 . . . . 72.54 110.669 169.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -78.03 -28.89 49.15 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.188 0.595 . . . . 60.24 110.968 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.443 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 19.2 m-30 -81.05 -5.8 58.05 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.767 0.827 . . . . 72.24 112.323 -178.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 97.1 p -60.14 -33.06 71.64 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.413 -0.588 . . . . 63.13 109.413 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -82.66 109.13 16.57 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.678 -1.23 . . . . 63.34 107.678 165.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.647 ' HG2' ' HB3' ' A' ' 22' ' ' LYS . 3.4 mpt_? -74.53 -25.65 59.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.25 0.62 . . . . 61.35 111.645 -172.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.3 m -62.84 -37.3 86.25 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.839 0.856 . . . . 53.32 110.592 174.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -60.35 -39.22 86.37 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 124.371 1.068 . . . . 75.2 111.072 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 26.0 mt -59.64 -53.96 41.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.201 0 O-C-N 123.829 0.706 . . . . 65.3 109.653 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 16.9 t -62.07 -38.05 87.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.13 0.572 . . . . 72.21 111.717 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.3 tpp180 -59.86 -47.88 83.97 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.389 1.076 . . . . 75.52 110.96 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.81 -22.39 40.07 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 116.15 -0.477 . . . . 75.01 110.555 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 17.3 tp -71.81 -41.24 68.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.776 0.831 . . . . 62.12 110.717 -173.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -71.22 -21.37 62.14 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.896 -0.593 . . . . 74.02 110.565 176.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.75 10.94 32.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.156 0.983 . . . . 55.52 111.058 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.4 t . . . . . 0 C--N 1.357 0.916 0 C-N-CA 123.14 0.576 . . . . 74.11 110.718 -174.879 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.803 HG13 ' HB2' ' A' ' 141' ' ' ALA . 1.4 mp . . . . . 0 N--CA 1.494 1.757 0 N-CA-C 108.15 -1.055 . . . . 65.31 108.15 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.4 HD12 ' HG2' ' A' ' 27' ' ' GLN . 26.3 mt -76.93 -46.84 22.82 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.909 0.862 . . . . 74.01 108.792 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.521 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 13.8 m-85 -98.51 34.6 1.98 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.152 -1.386 . . . . 73.52 110.455 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.663 ' HG3' HD13 ' A' ' 96' ' ' ILE . 22.1 ttpt -52.58 -65.2 0.6 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.735 0.698 . . . . 74.55 112.058 -172.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -65.92 -47.85 73.39 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.82 0.7 . . . . 74.54 110.558 -173.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 84.4 t -60.7 -57.82 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 124.287 0.992 . . . . 72.0 111.951 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -72.32 -24.16 61.27 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.811 0.844 . . . . 75.15 111.273 -174.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -66.94 -35.9 81.03 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.95 -0.389 . . . . 74.14 109.95 168.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 108' ' ' VAL . 60.1 mtpt -69.67 -37.81 76.83 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 119.113 -0.47 . . . . 63.12 110.64 172.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.584 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.9 mp -55.61 -45.2 77.54 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.553 -0.536 . . . . 74.2 109.553 171.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -63.11 -53.86 46.9 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 124.127 0.892 . . . . 42.14 110.885 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -60.7 -52.92 63.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.549 1.14 . . . . 70.43 111.508 -174.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.423 HG22 ' HE ' ' A' ' 64' ' ' ARG . 59.1 t -63.02 -42.97 98.69 Favored 'Isoleucine or valine' 0 C--N 1.344 0.346 0 O-C-N 124.07 0.856 . . . . 73.12 110.345 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 25.8 t-105 -61.76 -35.24 77.55 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.374 0.422 . . . . 73.33 111.403 177.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 57.6 mtpt -61.24 -55.35 32.99 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.712 -0.477 . . . . 74.14 109.712 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.1 -41.48 75.31 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.007 0.923 . . . . 73.53 111.05 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 3.7 tt -75.0 -47.78 27.42 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 114.115 -1.402 . . . . 72.04 110.45 -170.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.3 p -65.22 -33.41 75.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.222 0.609 . . . . 63.43 110.541 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.44 ' O ' HG23 ' A' ' 118' ' ' VAL . 80.0 mt -60.21 -57.13 14.12 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.892 0.745 . . . . 71.21 110.453 172.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.12 -23.77 67.23 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 111.801 0.297 . . . . 71.4 111.801 -178.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.7 mt -70.28 -45.58 66.06 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.876 -0.416 . . . . 72.34 109.876 171.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.424 ' O ' ' HA ' ' A' ' 121' ' ' ARG . 30.0 tt0 -77.13 -19.71 56.54 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.611 0.764 . . . . 61.11 111.185 -174.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 114' ' ' LEU . 64.1 t -91.36 -56.42 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 122.947 0.499 . . . . 74.34 110.288 177.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -73.51 -59.13 2.86 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.082 0.468 . . . . 71.44 110.736 -175.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -84.93 -16.43 41.1 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.588 -0.733 . . . . 72.33 110.767 -175.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 60.4 mtm-85 57.14 44.16 22.86 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.443 1.097 . . . . 54.24 110.013 -175.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.464 ' SD ' HD13 ' A' ' 116' ' ' LEU . 44.7 ttm -70.86 127.42 91.79 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 114.637 -1.165 . . . . 70.23 111.081 -174.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 6.3 Cg_exo . . . . . 0 C--N 1.371 1.727 0 C-N-CA 122.729 2.286 . . . . 64.33 109.846 170.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 112.292 0.479 . . . . 74.32 112.292 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -84.0 -34.08 24.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.0 0.52 . . . . 61.5 111.492 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -80.0 -33.05 39.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.897 0.879 . . . . 72.41 111.584 -173.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -59.88 -37.54 79.65 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 123.492 0.495 . . . . 63.51 109.825 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.87 -37.71 83.06 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.628 1.171 . . . . 75.35 111.573 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -68.84 -50.31 51.1 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.265 0.353 . . . . 73.03 111.287 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.1 -42.02 93.78 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 123.806 0.691 . . . . 74.02 110.481 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.468 ' HA ' ' HG2' ' A' ' 26' ' ' LYS . 1.4 t70 -60.7 -54.1 49.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.052 1.741 . . . . 63.02 110.918 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.803 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -53.98 -53.02 58.61 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.13 -1.396 . . . . 51.04 112.067 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.57 -45.33 85.32 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.1 -1.409 . . . . 73.32 111.114 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -64.22 -52.47 58.63 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 124.728 1.268 . . . . 53.21 111.159 -172.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.51 -38.01 68.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 124.022 0.826 . . . . 63.45 111.725 -174.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 149' ' ' GLN . 0.0 OUTLIER -57.41 -50.23 73.68 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.498 0.499 . . . . 62.11 109.891 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . 0.415 ' N ' ' HD3' ' A' ' 145' ' ' ARG . 5.7 tmm_? -71.47 -31.19 66.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.501 0.72 . . . . 63.45 110.035 -176.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.2 -19.83 53.09 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.189 0.596 . . . . 52.43 111.675 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -80.42 -50.94 9.43 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.772 -0.825 . . . . 75.15 108.772 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 145' ' ' ARG . 25.1 mm-40 -60.82 -60.19 4.19 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.902 0.752 . . . . 63.21 109.581 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 5.9 mmt -99.8 66.67 1.41 Allowed 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.361 1.064 . . . . 52.33 109.071 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 C--N 1.351 0.672 0 CA-C-O 121.986 0.898 . . . . 53.54 109.864 179.67 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 . . . . . 0 N--CA 1.482 1.144 0 CA-C-O 120.493 0.187 . . . . 64.31 110.964 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -68.88 -36.75 78.47 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 116.023 -0.535 . . . . 71.35 111.265 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.453 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.1 mm? -62.97 -47.26 83.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.544 0.337 . . . . 62.41 110.519 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HA ' ' NE2' ' A' ' 46' ' ' GLN . 51.8 tptt -57.42 -43.27 83.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.309 0.644 . . . . 72.41 109.829 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -61.57 -63.98 1.09 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-O 118.385 -0.816 . . . . 72.32 111.085 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.0 mt -47.98 -45.59 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.094 0.958 . . . . 71.31 112.917 -174.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -70.92 -48.55 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 115.647 -0.706 . . . . 44.15 110.987 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.1 m -61.62 -48.55 80.37 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 123.179 0.299 . . . . 74.1 110.305 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -57.19 -45.02 84.11 Favored 'General case' 0 C--O 1.208 -1.118 0 C-N-CA 124.648 1.179 . . . . 55.32 110.949 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.431 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -63.15 -42.29 99.49 Favored Glycine 0 C--N 1.347 1.167 0 O-C-N 124.244 0.965 . . . . 72.43 113.075 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -65.13 -43.24 92.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.198 0.599 . . . . 62.13 111.753 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -76.03 -25.29 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.619 0.767 . . . . 62.03 110.541 -178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.46 -51.77 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.841 0.856 . . . . 74.11 108.877 171.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -61.32 -36.54 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 124.12 0.888 . . . . 74.3 110.335 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -56.02 19.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.428 1.091 . . . . 74.21 110.56 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.491 ' HD2' HG13 ' A' ' 76' ' ' ILE . 5.2 ptp180 -75.84 -16.28 60.1 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.679 -0.691 . . . . 72.13 111.723 -178.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 48.2 t -72.15 -21.53 61.44 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.29 0.636 . . . . 70.24 110.54 172.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -81.18 0.01 38.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.502 0.721 . . . . 74.45 111.979 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.5 -29.73 70.41 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.457 -0.572 . . . . 55.41 109.457 165.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.1 mmt -71.15 89.57 0.85 Allowed 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.066 -0.516 . . . . 72.12 109.623 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -75.25 -27.21 59.37 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 108.496 -0.927 . . . . 72.32 108.496 170.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -93.33 172.32 8.36 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.597 1.159 . . . . 60.31 108.319 163.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.461 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 28.5 m 51.93 48.69 22.27 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.275 0.56 . . . . 53.25 110.878 -176.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 94.5 mttt -63.78 -41.04 98.02 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.047 -0.978 . . . . 72.13 111.035 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 0.5 OUTLIER -75.97 -22.92 55.4 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.958 -0.565 . . . . 54.33 109.735 -176.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.608 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 11.7 mm-40 -69.47 -40.56 77.02 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 123.005 0.522 . . . . 75.13 110.665 168.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.572 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 41.9 t -59.25 -42.63 91.55 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.359 0.663 . . . . 73.21 110.001 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 11.5 mpt_? -77.12 -30.31 55.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.429 -0.805 . . . . 74.44 111.859 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 ttp85 -71.39 -60.03 2.45 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.369 0.668 . . . . 63.02 110.453 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 18' ' ' CYS . 46.9 tp -56.61 -43.8 80.51 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.714 -1.13 . . . . 73.22 109.978 174.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.09 -49.12 74.27 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.103 0.877 . . . . 72.51 113.192 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -60.95 -47.76 84.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.811 0.845 . . . . 73.43 110.903 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 31.5 mtt180 -60.59 -60.33 3.98 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.093 0.871 . . . . 72.21 111.286 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.91 -45.07 75.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 124.306 1.004 . . . . 63.44 111.528 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.49 -44.16 97.57 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.623 0.577 . . . . 74.51 110.752 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.09 -25.82 71.14 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 123.517 0.511 . . . . 62.13 113.521 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 40.8 mt -79.96 -49.8 11.34 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.385 0.674 . . . . 74.13 110.983 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 10.5 pt -74.43 -33.69 33.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 CA-C-O 118.372 -0.823 . . . . 73.44 111.224 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -44.53 -58.61 4.95 Favored Pre-proline 0 N--CA 1.503 2.2 0 C-N-CA 124.914 1.286 . . . . 65.44 113.87 -170.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.46 ' HG2' HD22 ' A' ' 42' ' ' LEU . 35.0 Cg_endo -62.72 -42.05 27.69 Favored 'Trans proline' 0 C--N 1.401 3.338 0 C-N-CA 121.383 1.389 . . . . 75.34 110.692 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.6 mm? -70.11 -20.2 63.2 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.571 0.748 . . . . 63.4 111.499 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' HG23 ' A' ' 8' ' ' ILE . 63.7 mt-10 -73.62 -45.31 53.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.796 0.839 . . . . 73.02 109.561 175.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.4 -33.18 74.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.659 -0.7 . . . . 70.12 110.802 174.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.09 -21.06 36.97 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.007 0.923 . . . . 32.33 111.847 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' A' ' 5' ' ' LYS . 33.5 tt0 -75.27 -38.11 60.6 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.765 0.426 . . . . 55.15 110.042 173.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 t70 . . . . . 0 N--CA 1.477 0.893 0 C-N-CA 123.391 0.677 . . . . 71.04 110.407 176.332 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 110.389 -0.226 . . . . 73.54 110.389 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.47 -32.14 73.32 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 110.168 -0.308 . . . . 72.11 110.168 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -71.77 -30.87 66.03 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.487 0.315 . . . . 74.31 111.132 175.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.1 -51.21 57.08 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 107.883 -1.155 . . . . 73.44 107.883 176.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.1 m -58.06 -47.59 82.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.454 1.102 . . . . 75.14 111.198 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.4 m -65.88 -40.9 92.04 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.768 0.827 . . . . 70.33 111.14 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.48 -41.68 96.34 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.803 0.441 . . . . 70.01 110.283 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.51 -26.67 64.65 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.105 0.562 . . . . 55.22 111.261 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.51 ' HA ' ' HE2' ' A' ' 66' ' ' LYS . 84.8 m-20 -76.44 -38.28 55.73 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.466 0.706 . . . . 73.34 110.632 176.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.19 -39.51 78.64 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.737 0.815 . . . . 74.11 109.811 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -67.62 -49.0 65.17 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.286 1.034 . . . . 72.24 109.014 -177.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 63' ' ' ASN . 37.1 ttpt -55.59 -46.1 77.3 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.054 1.342 . . . . 74.13 111.754 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -70.56 -32.22 69.55 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.463 0.705 . . . . 75.11 111.454 -177.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -71.02 -32.43 69.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.356 0.662 . . . . 72.12 109.885 175.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 95.1 mt -73.11 -27.59 61.78 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.595 -0.73 . . . . 60.14 110.502 173.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -66.55 -41.78 88.16 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.777 0.431 . . . . 74.03 110.637 171.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.43 ' HB2' HG13 ' A' ' 101' ' ' VAL . 16.5 mm-40 -60.58 -49.29 78.13 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.63 0.581 . . . . 64.13 109.977 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.506 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.18 -46.8 88.47 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.9 0.75 . . . . 73.42 111.264 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.19 -47.53 78.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.5 1.12 . . . . 74.23 110.599 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.73 -37.73 94.72 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.083 -0.962 . . . . 63.2 112.878 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -61.46 -53.07 61.3 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.0 0.52 . . . . 71.42 110.978 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.568 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -69.12 -20.31 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 N-CA-C 112.239 0.459 . . . . 72.04 112.239 179.305 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -67.26 -41.03 86.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.262 0.553 . . . . 64.01 111.055 168.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -71.97 -30.23 65.06 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.127 -0.942 . . . . 73.42 110.816 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.4 m-85 -83.97 -8.17 59.22 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.741 0.817 . . . . 72.31 112.271 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 9.1 t -61.9 -22.11 65.3 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.241 0.543 . . . . 73.45 110.291 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -86.05 108.55 18.31 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.212 -1.033 . . . . 64.43 108.212 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -75.54 -23.84 56.67 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.864 0.465 . . . . 74.35 110.595 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.1 m -67.9 -35.0 77.72 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.131 0.572 . . . . 74.42 110.58 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -64.07 -38.3 90.58 Favored 'General case' 0 C--O 1.25 1.11 0 C-N-CA 123.209 0.604 . . . . 73.33 110.096 175.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.497 HG23 HD11 ' A' ' 97' ' ' LEU . 32.8 mt -59.81 -56.73 15.42 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 123.816 0.698 . . . . 72.32 109.177 174.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -56.54 -38.22 71.56 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.361 0.664 . . . . 71.23 111.762 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 ttm180 -56.05 -59.18 5.28 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 124.664 1.228 . . . . 75.51 111.028 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.75 -25.6 56.67 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 116.058 -0.519 . . . . 75.42 110.206 -175.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.46 HD23 HE21 ' A' ' 149' ' ' GLN . 16.6 tp -74.13 -41.33 61.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.547 0.739 . . . . 74.51 110.03 -169.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -66.17 -22.76 66.37 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 123.434 0.459 . . . . 73.4 110.598 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 -28.91 19.2 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.056 0.943 . . . . 64.04 111.546 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.4 p . . . . . 0 N--CA 1.475 0.809 0 C-N-CA 122.917 0.487 . . . . 71.04 111.34 -174.01 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.417 HD11 ' HA ' ' A' ' 138' ' ' GLN . 3.0 mp . . . . . 0 N--CA 1.471 0.621 0 N-CA-C 108.664 -0.865 . . . . 55.34 108.664 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.608 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 9.3 tp -56.48 -30.37 62.87 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 124.329 1.018 . . . . 62.11 112.074 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 28.1 m-85 -121.57 26.94 8.5 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 114.616 -1.174 . . . . 72.32 111.716 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -40.03 -63.71 0.58 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.398 1.079 . . . . 71.5 112.183 -169.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.48 -61.55 2.51 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.581 1.152 . . . . 72.13 111.86 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.43 HG13 ' HB2' ' A' ' 71' ' ' GLU . 96.9 t -59.79 -56.32 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.681 1.192 . . . . 72.21 111.685 -172.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.483 ' HB2' ' HB3' ' A' ' 98' ' ' PHE . 50.7 t30 -61.07 -33.63 73.64 Favored 'General case' 0 C--O 1.245 0.864 0 C-N-CA 124.926 1.29 . . . . 74.33 112.517 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -41.36 97.31 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 109.47 -0.567 . . . . 65.53 109.47 172.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -68.85 -31.9 71.19 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.786 -0.643 . . . . 73.44 112.442 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.81 -49.36 78.0 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.533 -0.543 . . . . 73.51 109.533 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.7 t -66.51 -32.77 74.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.806 0.842 . . . . 72.45 111.52 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 15.0 t70 -70.19 -51.39 31.47 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.656 0.783 . . . . 74.32 110.433 -178.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.5 -27.67 37.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-N 116.042 -0.526 . . . . 73.1 110.337 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 48.5 t-105 -69.42 -37.15 77.3 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 122.804 0.442 . . . . 75.34 111.462 174.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 32.5 pttt -66.49 -40.04 89.07 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 108.217 -1.031 . . . . 74.21 108.217 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 42.0 mt-10 -60.56 -47.96 83.87 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 123.526 0.516 . . . . 74.34 110.41 174.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.403 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -56.51 -61.36 2.46 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 124.842 1.339 . . . . 63.21 108.718 -177.599 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.4 t -49.26 -43.41 42.92 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.03 1.332 . . . . 52.45 111.274 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.419 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.4 mt -58.3 -66.15 0.53 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 123.832 0.708 . . . . 74.43 111.896 175.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.9 pp -62.93 -27.68 69.55 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.241 0.46 . . . . 64.43 112.241 -172.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.46 ' HB3' ' HE3' ' A' ' 122' ' ' MET . 95.1 mt -70.69 -48.36 55.11 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.067 0.947 . . . . 73.44 110.673 176.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -78.83 -20.68 49.06 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.508 0.323 . . . . 74.13 111.644 -175.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 114' ' ' LEU . 98.1 t -81.1 -55.38 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 110.014 -0.365 . . . . 60.42 110.014 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -87.56 -58.52 2.55 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 111.729 0.27 . . . . 54.42 111.729 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -76.81 -8.02 56.53 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.417 0.287 . . . . 74.52 111.239 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 58.31 32.88 22.6 Favored 'General case' 0 C--N 1.36 1.027 0 C-N-CA 124.621 1.168 . . . . 72.21 111.243 177.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.46 ' HE3' ' HB3' ' A' ' 116' ' ' LEU . 35.0 ttm -72.24 124.92 91.47 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 114.93 -1.032 . . . . 75.12 110.921 -174.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo . . . . . 0 C--N 1.367 1.533 0 C-N-CA 122.463 2.109 . . . . 74.53 110.984 178.327 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.419 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.7 m0 . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 114.258 1.207 . . . . 75.32 114.258 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.44 -39.48 46.67 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.672 0.272 . . . . 55.31 110.981 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -67.37 -47.73 69.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.656 0.782 . . . . 74.01 110.181 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -57.45 -63.04 1.37 Allowed 'General case' 0 C--N 1.355 0.809 0 CA-C-N 114.412 -1.267 . . . . 73.15 110.636 -170.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -56.21 -38.66 71.31 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.736 1.272 . . . . 74.21 112.66 -176.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . 0.417 ' HA ' HD11 ' A' ' 96' ' ' ILE . 6.4 tp-100 -58.18 -60.42 3.78 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.085 0.865 . . . . 75.42 110.43 178.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -68.73 -39.63 80.27 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.562 -0.745 . . . . 73.1 111.362 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.93 -57.98 10.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.929 1.692 . . . . 72.51 110.029 -177.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.404 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -75.29 -25.03 57.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 114.226 -1.352 . . . . 74.12 112.252 -174.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . 0.471 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 22.0 t70 -61.09 -56.05 25.38 Favored 'General case' 0 C--N 1.349 0.58 0 O-C-N 123.724 0.64 . . . . 72.11 109.315 172.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.84 -33.36 75.8 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.488 1.117 . . . . 74.3 111.695 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 25.5 t0 -74.15 -32.63 63.22 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.197 0.311 . . . . 74.23 111.114 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -67.07 -37.05 83.31 Favored 'General case' 0 C--N 1.355 0.81 0 N-CA-C 109.222 -0.658 . . . . 73.44 109.222 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 10.8 mmt180 -63.77 -44.1 94.42 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.558 -0.534 . . . . 73.53 109.558 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.93 74.59 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.716 0.806 . . . . 72.33 111.862 -176.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.461 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -76.47 -61.65 1.89 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 109.842 -0.429 . . . . 65.01 109.842 178.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . 0.46 HE21 HD23 ' A' ' 89' ' ' LEU . 86.7 mm-40 -68.82 -33.04 73.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.62 0.768 . . . . 73.25 111.173 -170.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.9 ttm -117.18 80.28 1.46 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.537 -1.282 . . . . 45.2 107.537 171.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 26.1 tp . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 122.115 0.96 . . . . 71.45 108.479 176.895 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 . . . . . 0 N--CA 1.471 0.601 0 N-CA-C 110.583 -0.154 . . . . 61.4 110.583 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.548 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 59.9 m-20 -56.38 -53.86 52.39 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 124.059 0.85 . . . . 74.03 110.784 175.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.7 mt -56.57 -46.36 80.82 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.999 0.812 . . . . 74.03 111.804 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -54.79 -47.61 73.77 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.618 0.574 . . . . 73.41 110.707 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -69.46 -42.17 75.24 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 118.826 -0.607 . . . . 75.35 112.415 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.08 -43.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 123.829 0.852 . . . . 62.22 110.514 -177.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 29.5 mm -67.69 -42.84 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.029 -0.987 . . . . 61.4 110.471 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.2 m -60.68 -48.98 79.34 Favored 'General case' 0 C--N 1.357 0.91 0 O-C-N 123.523 0.515 . . . . 61.33 110.539 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -55.12 -49.97 70.42 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 123.995 0.918 . . . . 75.31 110.119 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.96 -48.45 79.01 Favored Glycine 0 C--N 1.343 0.92 0 O-C-N 124.844 1.34 . . . . 74.24 112.973 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.1 mt-30 -62.44 -49.38 75.68 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.799 0.44 . . . . 73.03 111.284 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.9 -34.92 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.891 0.877 . . . . 62.3 110.764 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.473 HD11 ' O ' ' A' ' 69' ' ' LEU . 8.6 mt -62.92 -48.27 88.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.824 1.25 . . . . 71.2 110.505 177.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -62.76 -36.58 83.51 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 123.994 0.809 . . . . 63.23 110.355 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.8 mmmt -66.24 -48.17 71.4 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.669 0.605 . . . . 62.21 112.083 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -77.66 -17.99 57.16 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.346 0.258 . . . . 73.43 111.646 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.442 ' SG ' HD23 ' A' ' 31' ' ' LEU . 53.0 t -71.33 -22.24 61.94 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.58 0.752 . . . . 71.44 111.031 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.48 -16.69 64.31 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.722 0.409 . . . . 73.43 111.3 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -68.62 -17.18 64.06 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.124 0.57 . . . . 74.32 112.325 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.494 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 5.7 mmt -76.74 83.29 3.35 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.596 -0.52 . . . . 72.22 109.596 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -40.97 72.75 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.703 -1.221 . . . . 73.43 107.703 174.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -92.77 154.53 18.23 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.239 -1.346 . . . . 73.32 108.543 170.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 144' ' ' ASP . 80.9 m 58.97 58.83 3.02 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.977 0.894 . . . . 50.25 109.344 -171.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -73.36 -34.39 65.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 114.199 -1.364 . . . . 71.52 111.472 -169.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -81.74 -27.66 33.72 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.047 -0.723 . . . . 52.21 109.047 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.661 ' HG3' ' HG ' ' A' ' 97' ' ' LEU . 27.4 mm-40 -61.28 -40.65 94.92 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.423 0.689 . . . . 65.12 110.537 165.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 42.5 t -65.55 -36.17 83.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.692 0.797 . . . . 51.53 110.982 176.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -71.97 -31.95 66.78 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.207 0.603 . . . . 60.24 110.92 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.483 ' CZ ' ' HB3' ' A' ' 136' ' ' GLU . 21.5 mmt180 -69.14 -52.33 29.22 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.782 0.433 . . . . 64.05 110.373 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.442 HD23 ' SG ' ' A' ' 18' ' ' CYS . 29.7 tp -65.3 -38.85 91.49 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.62 0.575 . . . . 71.53 110.243 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.87 -54.41 38.2 Favored Glycine 0 C--N 1.346 1.111 0 O-C-N 123.691 0.619 . . . . 73.25 112.915 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -64.6 -44.37 90.83 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.848 0.859 . . . . 71.13 110.781 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.492 ' HG2' ' CE2' ' A' ' 133' ' ' TRP . 39.5 mtm180 -57.78 -60.6 3.45 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.084 0.865 . . . . 73.02 110.406 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.09 -51.58 69.08 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.576 0 O-C-N 124.311 1.007 . . . . 50.1 112.1 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.6 -45.65 93.21 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 118.064 0.393 . . . . 74.42 111.01 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -73.18 -18.36 79.19 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.943 -0.571 . . . . 71.42 113.448 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 12.6 tp -87.35 -40.01 14.82 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.52 0.728 . . . . 75.42 111.124 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.415 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 11.8 pt -79.73 -34.56 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 119.058 -0.496 . . . . 74.33 110.361 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -53.68 -50.64 82.34 Favored Pre-proline 0 CA--C 1.562 1.414 0 CA-C-O 117.929 -1.034 . . . . 75.02 113.415 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.64 -39.84 78.96 Favored 'Trans proline' 0 C--N 1.4 3.265 0 C-N-CA 121.699 1.6 . . . . 74.44 112.265 177.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 45' ' ' LEU . 4.0 mm? -69.48 -31.99 70.61 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.62 -0.718 . . . . 61.52 111.072 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 52.6 mt-10 -70.31 -38.9 75.05 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.065 0.546 . . . . 73.23 111.153 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.0 mtm -61.77 -46.13 90.92 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 123.625 0.578 . . . . 53.03 111.47 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 42' ' ' LEU . 3.7 pp -75.25 -33.06 61.25 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 116.323 -0.399 . . . . 75.23 111.007 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.7 -32.95 74.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.148 0.579 . . . . 74.22 110.572 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 . . . . . 0 N--CA 1.473 0.692 0 C-N-CA 123.936 0.894 . . . . 74.41 111.902 -179.022 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.524 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 28.9 m . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 119.865 -0.112 . . . . 74.1 111.033 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -61.07 -45.28 95.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.128 0.571 . . . . 64.22 111.111 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -59.08 -41.38 87.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.088 0.555 . . . . 75.4 110.878 176.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 55' ' ' SER . 12.2 tp -65.53 -48.77 71.34 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.641 -1.163 . . . . 74.14 110.151 -172.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.2 m -67.28 -39.27 86.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 114.915 -1.039 . . . . 71.11 111.05 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.9 m -65.62 -36.9 85.05 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.145 0.578 . . . . 64.14 111.256 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.28 -45.51 84.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.186 0.595 . . . . 74.21 109.774 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.548 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.8 mmt -68.71 -20.87 64.42 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.034 -0.985 . . . . 72.21 112.327 176.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -74.62 -42.86 57.85 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.242 0.617 . . . . 70.13 109.905 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.15 -41.5 98.34 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.287 0.635 . . . . 74.3 109.827 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.412 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -64.9 -50.99 64.34 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.396 -1.274 . . . . 65.43 109.75 -177.023 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -53.62 -49.37 67.99 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.311 1.044 . . . . 64.1 110.357 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.76 80.11 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.315 1.009 . . . . 72.25 111.773 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.59 -43.04 85.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.303 0.641 . . . . 61.4 110.862 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -70.36 -25.82 63.44 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.365 0.666 . . . . 75.35 111.559 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -65.25 -50.45 65.73 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.078 0.466 . . . . 55.3 109.949 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -64.61 -38.96 92.8 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 114.96 -1.018 . . . . 60.32 110.746 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.72 -47.33 85.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.082 0.553 . . . . 70.53 110.904 176.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.67 -38.46 81.55 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.155 0.91 . . . . 73.31 110.814 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.36 -42.04 75.79 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 123.962 0.789 . . . . 62.41 113.118 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.08 -41.59 94.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 122.605 0.362 . . . . 71.34 111.073 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 4.3 pt -80.76 -18.5 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.502 0.556 . . . . 63.52 112.502 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -64.68 -33.69 76.54 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.127 -0.694 . . . . 71.43 109.127 165.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -76.75 -39.53 51.44 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.754 -0.657 . . . . 71.3 110.894 173.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.518 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.4 m-30 -74.11 -12.4 60.59 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 112.867 0.692 . . . . 72.42 112.867 -177.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.2 p -61.0 -31.12 70.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.024 0.44 . . . . 64.32 110.276 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -89.65 115.87 27.35 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.179 -1.045 . . . . 74.5 108.179 167.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -74.35 -25.13 59.34 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.784 0.834 . . . . 72.32 110.992 -172.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -68.71 -34.45 75.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.628 0.771 . . . . 71.01 110.31 174.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.9 -35.54 74.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.398 0.679 . . . . 72.22 110.359 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.5 mt -58.65 -58.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 N-CA-C 108.827 -0.805 . . . . 73.52 108.827 171.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.0 t -53.0 -37.98 61.92 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.005 0.922 . . . . 41.0 111.825 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -62.6 -52.26 64.07 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-N 115.123 -0.944 . . . . 75.04 111.266 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -28.94 64.41 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.146 -0.316 . . . . 74.31 110.146 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 145' ' ' ARG . 11.5 tp -74.81 -39.36 61.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.695 1.198 . . . . 72.42 111.524 -166.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -67.22 -22.94 65.69 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.235 -0.893 . . . . 64.14 110.661 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.3 -10.2 17.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.509 0.724 . . . . 64.13 112.149 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 92.2 p . . . . . 0 N--CA 1.476 0.864 0 C-N-CA 122.682 0.393 . . . . 73.14 110.139 179.617 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.406 HG22 ' H ' ' A' ' 98' ' ' PHE . 2.5 mp . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 108.593 -0.892 . . . . 53.33 108.593 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.661 ' HG ' ' HG3' ' A' ' 27' ' ' GLN . 15.5 mt -65.19 -38.98 92.2 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 122.173 0.987 . . . . 75.44 110.093 177.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 56.7 m-85 -107.07 43.86 1.12 Allowed 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 113.715 -1.584 . . . . 71.31 109.445 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -63.46 -64.81 0.8 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.357 -0.979 . . . . 73.55 108.357 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.74 -42.82 85.65 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.785 -1.098 . . . . 74.34 110.302 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.49 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 50.0 t -59.65 -54.74 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 124.149 0.906 . . . . 73.13 111.278 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.406 HD21 ' HB3' ' A' ' 133' ' ' TRP . 65.2 t30 -72.07 -25.82 61.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 119.186 -0.435 . . . . 74.24 110.727 -176.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -61.0 -43.93 98.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 109.815 -0.439 . . . . 75.11 109.815 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.49 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 42.5 mttm -60.36 -57.45 12.72 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.902 0.881 . . . . 72.44 110.744 175.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.2 mp -54.6 -41.0 69.43 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.9 0.75 . . . . 75.12 111.348 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.2 t -71.64 -42.11 67.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.346 0.658 . . . . 43.54 111.264 -176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 17.7 t70 -71.93 -44.96 62.77 Favored 'General case' 0 C--O 1.254 1.305 0 O-C-N 123.623 0.577 . . . . 63.1 110.718 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.7 t -58.57 -49.74 81.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 CA-C-N 115.003 -0.999 . . . . 72.22 109.173 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -64.16 -29.07 70.21 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.011 0.819 . . . . 71.52 111.83 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.731 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 40.8 mtpt -56.69 -67.69 0.29 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 108.54 -0.911 . . . . 63.43 108.54 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.16 -29.84 71.11 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 124.084 0.865 . . . . 71.44 111.902 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.3 tt -72.52 -50.21 27.38 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.622 0.769 . . . . 74.42 110.142 -175.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.4 p -62.08 -37.6 85.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.446 0.298 . . . . 51.32 110.689 177.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 94.1 mt -60.11 -44.62 94.72 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.372 -0.831 . . . . 74.42 111.701 176.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -78.49 -21.8 48.43 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 112.23 0.456 . . . . 64.44 112.23 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 84.7 mt -63.97 -43.19 96.53 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.918 -0.771 . . . . 61.12 108.918 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.444 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.69 -47.47 66.34 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.698 0.799 . . . . 51.24 112.269 175.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.2 t -64.19 -60.65 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.23 0.612 . . . . 73.32 111.372 -177.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -86.32 -54.47 4.42 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.797 -0.638 . . . . 62.34 111.37 -168.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -88.37 -6.27 57.81 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.503 0.557 . . . . 74.45 112.503 -175.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 52.7 ttt85 66.16 7.57 4.91 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.854 1.262 . . . . 72.22 112.771 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 37.1 mtp -65.46 118.34 49.63 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.258 1.023 . . . . 65.52 111.423 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo . . . . . 0 C--N 1.377 2.051 0 C-N-CA 123.612 2.874 . . . . 71.14 112.559 -176.647 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.492 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 37.3 m0 . . . . . 0 N--CA 1.47 0.561 0 N-CA-C 113.141 0.793 . . . . 72.33 113.141 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.46 -27.97 69.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.749 0.42 . . . . 64.03 111.612 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -88.81 -46.6 8.83 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.636 0.774 . . . . 62.21 110.705 174.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 49.8 mt-10 -64.11 -62.56 1.55 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.152 0.981 . . . . 72.22 111.6 -174.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -53.84 -34.07 58.18 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.871 0.869 . . . . 72.24 111.895 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -67.13 -52.04 46.56 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.109 0.564 . . . . 73.24 112.216 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.74 -48.69 80.67 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.556 0.535 . . . . 64.43 109.902 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.47 -38.31 86.8 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 114.248 -1.342 . . . . 64.23 110.313 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.0 97.6 Favored 'General case' 0 C--O 1.22 -0.46 0 O-C-N 124.121 0.888 . . . . 51.44 112.374 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.33 -47.78 84.36 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 109.181 -0.674 . . . . 74.15 109.181 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.93 -48.25 82.13 Favored 'General case' 0 CA--C 1.555 1.141 0 O-C-N 124.389 1.055 . . . . 74.11 111.35 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 24' ' ' CYS . 64.3 m-20 -70.33 -56.11 7.51 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.079 0.952 . . . . 62.43 112.378 -176.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.513 ' HG2' HD11 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -62.11 -43.07 99.65 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.318 1.047 . . . . 72.32 109.738 -173.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -63.45 -49.76 72.4 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 123.971 0.794 . . . . 75.43 109.632 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.73 70.71 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 112.312 0.486 . . . . 71.12 112.312 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -45.62 60.27 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.31 0.644 . . . . 70.42 109.555 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -76.51 -13.25 60.11 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 115.754 -0.657 . . . . 75.13 112.096 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 48.8 mtm -97.57 -77.59 0.5 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.084 -0.709 . . . . 63.53 109.084 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 95.8 mt . . . . . 0 N--CA 1.488 1.429 0 C-N-CA 124.907 1.283 . . . . 53.34 111.663 -172.375 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 119.642 -0.218 . . . . 75.32 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -55.42 -45.05 76.75 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.857 0.863 . . . . 64.22 110.535 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.12 -41.53 94.77 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.364 -0.834 . . . . 64.05 110.69 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -57.19 -43.4 82.63 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.746 0.654 . . . . 75.53 110.862 177.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -60.71 -55.71 29.95 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.619 0.574 . . . . 72.32 110.584 178.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.26 -49.39 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.817 0.847 . . . . 72.43 111.761 -177.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 80.5 mt -71.12 -43.59 75.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.708 1.203 . . . . 73.41 111.197 -172.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 13' ' ' VAL . 97.5 m -63.45 -48.88 75.89 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.697 0.399 . . . . 65.31 110.536 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.1 mt -53.71 -50.36 66.07 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.05 0.843 . . . . 75.15 110.471 177.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.69 -52.31 46.56 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 124.602 1.189 . . . . 73.51 112.996 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.69 -48.24 82.45 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.773 0.429 . . . . 64.24 111.463 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 9' ' ' THR . 46.5 t -68.34 -25.24 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.086 0.554 . . . . 73.41 111.061 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.489 HD11 ' O ' ' A' ' 69' ' ' LEU . 33.4 mt -64.43 -48.4 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.83 0.852 . . . . 70.4 109.181 172.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.469 ' HB2' HG11 ' A' ' 35' ' ' VAL . 38.9 t-80 -59.37 -37.71 78.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.404 0.681 . . . . 74.03 111.134 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -63.75 -59.02 5.1 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.804 0.69 . . . . 74.23 110.966 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -74.69 -16.82 60.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.063 0.545 . . . . 75.31 111.755 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.63 -23.22 65.32 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.365 0.666 . . . . 73.11 111.289 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.96 -8.52 53.7 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.165 0.586 . . . . 73.33 111.653 178.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.85 -23.27 67.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.597 0.359 . . . . 63.01 111.153 170.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 7.2 mmt -74.88 87.44 2.28 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.697 -0.853 . . . . 72.3 108.697 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -36.09 75.13 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 107.359 -1.348 . . . . 72.53 107.359 168.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -89.72 175.91 7.06 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.622 -1.172 . . . . 74.21 108.454 171.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.613 ' SG ' HG21 ' A' ' 85' ' ' ILE . 99.9 m 57.79 74.03 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.796 0.685 . . . . 61.23 110.405 -172.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.76 -60.44 3.09 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.731 1.212 . . . . 73.21 110.585 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.569 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 57.5 mmtt -63.67 -49.46 73.07 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 115.145 -0.934 . . . . 75.24 110.381 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 14.0 mt-30 -60.55 -34.91 74.83 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.1 0.56 . . . . 75.23 112.243 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.4 t -74.21 -44.43 53.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.619 0.368 . . . . 72.14 110.948 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -65.79 -38.82 90.05 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 122.713 0.405 . . . . 74.42 110.911 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' NH2' ' HA ' ' A' ' 137' ' ' ASP . 18.2 mtp180 -67.9 -38.47 83.01 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.123 0.969 . . . . 64.03 110.627 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER -60.05 -50.81 72.24 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.995 0.81 . . . . 73.32 108.91 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -40.2 97.31 Favored Glycine 0 C--N 1.348 1.211 0 O-C-N 123.971 0.795 . . . . 64.13 113.202 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -57.0 -47.76 80.05 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.35 1.06 . . . . 74.43 110.71 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.412 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 69.5 mtt-85 -64.68 -48.78 73.47 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 114.726 -1.124 . . . . 73.41 110.753 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.469 HG11 ' HB2' ' A' ' 15' ' ' HIS . 41.7 t -54.09 -61.62 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.518 0 O-C-N 124.148 0.905 . . . . 60.42 111.185 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.488 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 72.2 mt -65.39 -46.42 80.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.074 0.859 . . . . 61.51 110.564 -172.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -37.78 76.97 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 116.058 -0.519 . . . . 74.3 113.069 176.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 65' ' ' PHE . 18.0 tp -84.33 -38.13 20.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.853 0.861 . . . . 73.45 112.471 -173.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.437 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 16.3 pt -75.46 -37.45 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 119.42 -0.324 . . . . 74.2 110.871 -176.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' A' ' 36' ' ' LEU . 5.6 mptp? -51.7 -51.81 66.59 Favored Pre-proline 0 N--CA 1.485 1.296 0 N-CA-C 114.021 1.119 . . . . 75.11 114.021 -174.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 19.6 Cg_endo -55.43 -37.52 94.74 Favored 'Trans proline' 0 C--N 1.395 3.007 0 C-N-CA 122.357 2.038 . . . . 64.43 112.669 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 -40.77 76.19 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.377 0.671 . . . . 72.33 110.658 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 92.7 mt-10 -66.74 -37.13 84.04 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.405 1.082 . . . . 74.42 111.299 -179.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 34.6 mmt -65.76 -40.15 91.77 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.728 0.642 . . . . 64.31 110.431 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -76.82 -38.26 54.18 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.281 -0.418 . . . . 62.34 110.403 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -39.2 87.65 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.485 0.714 . . . . 54.42 111.67 -178.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 . . . . . 0 N--CA 1.473 0.709 0 C-N-CA 123.866 0.866 . . . . 61.25 110.899 -178.196 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.476 0.834 0 N-CA-C 109.684 -0.487 . . . . 71.11 109.684 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -59.98 -38.29 82.12 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.958 0.503 . . . . 74.41 110.735 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HG3' HD22 ' A' ' 58' ' ' LEU . 61.8 pttt -62.42 -37.27 85.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.371 0.668 . . . . 55.24 111.626 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 115' ' ' LEU . 4.0 mm? -65.96 -51.12 61.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.674 0.39 . . . . 73.12 110.172 175.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.5 m -58.67 -45.42 89.42 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.11 0.881 . . . . 70.15 111.229 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 51.0 m -59.73 -44.89 93.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.875 0.87 . . . . 65.32 110.212 176.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.67 -44.44 96.47 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.706 0.629 . . . . 75.41 111.494 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.6 mmt -67.45 -31.47 71.66 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.82 0.848 . . . . 61.31 111.141 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -74.29 -44.9 50.78 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.677 0.791 . . . . 73.22 111.057 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -61.25 -44.2 97.63 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.768 0.827 . . . . 73.14 109.727 175.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.46 ' HE1' HD21 ' A' ' 38' ' ' LEU . 3.4 t80 -59.62 -58.13 9.93 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 113.533 -1.667 . . . . 51.11 109.958 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.9 ttpp -52.71 -45.53 66.93 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 124.6 1.187 . . . . 73.2 110.913 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.82 79.03 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 124.311 1.007 . . . . 70.53 111.785 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.15 -34.8 71.34 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.339 0.656 . . . . 72.01 111.737 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.489 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -63.84 -40.12 95.84 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 122.554 0.342 . . . . 63.1 110.737 170.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 37.5 mt-10 -63.4 -42.07 98.77 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.151 0.58 . . . . 73.05 110.413 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 39.1 mt-10 -58.26 -54.65 44.65 Favored 'General case' 0 C--N 1.355 0.837 0 CA-C-N 114.907 -1.042 . . . . 71.22 110.124 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.19 -43.67 78.67 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.569 1.168 . . . . 74.41 111.884 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.06 -51.64 68.48 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 124.68 1.237 . . . . 54.2 109.854 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.04 -31.31 80.48 Favored Glycine 0 CA--C 1.535 1.282 0 CA-C-N 115.036 -0.984 . . . . 71.21 114.171 178.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 29.8 mm-40 -67.65 -56.42 9.45 Favored 'General case' 0 C--N 1.356 0.879 0 CA-C-N 116.947 0.373 . . . . 74.35 110.396 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -59.29 -28.26 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.937 -0.477 . . . . 74.43 111.43 175.557 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.07 -46.52 89.31 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.037 0.384 . . . . 52.21 112.037 171.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 14.1 ptpt -73.77 -25.29 60.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 117.852 0.296 . . . . 60.43 110.87 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.58 -2.41 57.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.541 0.736 . . . . 74.35 112.851 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.9 p -57.13 -31.14 65.02 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.978 0.511 . . . . 74.44 111.189 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -83.83 115.51 22.28 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 107.913 -1.143 . . . . 63.52 107.913 165.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -74.3 -23.02 59.03 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.482 0.713 . . . . 63.4 111.083 -172.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.8 p -59.82 -32.34 70.56 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.071 0.948 . . . . 71.53 111.765 171.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -63.17 -42.28 99.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.423 0.689 . . . . 64.03 110.327 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.613 HG21 ' SG ' ' A' ' 24' ' ' CYS . 52.5 mt -59.63 -58.7 5.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 114.812 -1.086 . . . . 63.32 109.44 178.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.0 t -56.5 -35.6 68.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.153 0.581 . . . . 74.32 111.693 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -57.38 -58.32 8.78 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.426 1.09 . . . . 53.32 111.621 178.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.405 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 1.7 p90 -75.47 -34.7 60.93 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.779 -0.452 . . . . 72.32 109.779 -177.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.555 HD23 HE22 ' A' ' 149' ' ' GLN . 12.7 tp -66.32 -37.94 86.52 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.65 1.18 . . . . 75.25 111.503 -168.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -66.67 -19.43 65.76 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.86 -0.609 . . . . 73.41 111.221 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.94 -23.0 14.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.101 0.96 . . . . 70.45 111.423 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 74.4 m . . . . . 0 N--CA 1.479 0.979 0 C-N-CA 124.368 1.067 . . . . 63.24 110.721 -174.308 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' A' ' 141' ' ' ALA . 14.1 mm . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 108.826 -0.805 . . . . 72.4 108.826 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.405 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 2.0 tp -50.54 -43.71 56.2 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.632 0.729 . . . . 75.31 111.582 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 3.5 m-85 -118.05 25.09 10.58 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 114.421 -1.263 . . . . 55.34 110.797 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -40.34 -56.95 1.87 Allowed 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 124.535 1.134 . . . . 63.4 112.559 -167.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.96 -55.32 8.59 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.184 0.993 . . . . 65.03 111.074 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.4 -46.1 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 124.29 1.036 . . . . 71.11 111.954 -174.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.412 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 51.0 t30 -76.38 -28.73 56.87 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.983 1.313 . . . . 73.13 110.407 -177.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -62.48 -39.4 93.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 109.85 -0.426 . . . . 71.41 109.85 168.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -68.39 -36.94 79.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.38 0.672 . . . . 64.4 110.464 175.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.84 -39.15 90.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.854 0.461 . . . . 72.01 110.777 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 66.1 m -72.6 -41.06 66.02 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.368 0.667 . . . . 71.12 111.209 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.497 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 15.9 t70 -80.1 -36.3 35.63 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.748 0.419 . . . . 70.44 110.599 -176.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.2 t -69.85 -28.78 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 110.084 -0.339 . . . . 63.34 110.084 172.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -69.43 -34.84 75.03 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 119.333 -0.365 . . . . 70.52 110.703 170.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 51.8 mtpt -57.22 -57.61 11.85 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 109.616 -0.513 . . . . 71.12 109.616 171.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.2 mt-10 -51.72 -47.18 64.09 Favored 'General case' 0 C--N 1.358 0.94 0 O-C-N 124.447 1.092 . . . . 72.55 110.415 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -64.08 -60.46 3.21 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 124.176 0.99 . . . . 72.4 109.965 -173.057 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -53.27 -38.94 63.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.065 0.946 . . . . 63.52 111.513 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 118' ' ' VAL . 96.6 mt -60.2 -62.78 1.61 Allowed 'General case' 0 CA--C 1.545 0.777 0 O-C-N 123.703 0.627 . . . . 65.33 111.149 175.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 58' ' ' LEU . 2.5 pp -65.9 -23.15 66.58 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.724 0.639 . . . . 72.23 112.724 -176.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.419 HD13 ' SD ' ' A' ' 122' ' ' MET . 80.8 mt -72.86 -42.28 63.84 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 123.483 0.713 . . . . 71.44 110.001 175.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -75.77 -26.01 56.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.506 0.322 . . . . 63.24 111.402 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 114' ' ' LEU . 77.8 t -75.25 -61.81 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.695 -0.483 . . . . 64.32 109.695 177.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -59.02 2.37 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.977 0.511 . . . . 75.31 110.066 -170.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.4 ' OE1' ' HA ' ' A' ' 116' ' ' LEU . 27.8 mp0 -76.85 -14.09 59.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.241 0.616 . . . . 74.4 111.569 -174.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 63.65 22.84 13.3 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 124.884 1.274 . . . . 75.44 111.04 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.528 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 48.6 ttm -55.45 115.41 9.24 Favored Pre-proline 0 C--N 1.357 0.894 0 C-N-CA 124.654 1.182 . . . . 71.54 111.999 -173.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo . . . . . 0 C--N 1.367 1.502 0 C-N-CA 122.108 1.872 . . . . 61.4 109.72 172.566 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.404 ' HH2' HD22 ' A' ' 38' ' ' LEU . 11.3 m0 . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 113.286 0.847 . . . . 75.31 113.286 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.52 -40.76 18.76 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.781 -0.574 . . . . 70.21 110.721 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -73.35 -39.05 65.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.989 -1.005 . . . . 71.4 111.481 -171.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' ' 140' ' ' ASP . 41.7 mt-10 -52.59 -56.82 12.63 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 124.917 1.287 . . . . 75.14 111.068 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.498 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 3.5 m-20 -63.5 -57.64 9.57 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.031 -0.986 . . . . 74.1 112.368 -172.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -59.23 -58.89 6.66 Favored 'General case' 0 CA--C 1.561 1.404 0 O-C-N 123.062 0.226 . . . . 75.51 111.406 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.82 -56.19 6.87 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 122.36 0.264 . . . . 74.2 110.63 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 136' ' ' GLU . 5.5 m-20 -74.99 -28.84 60.7 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.299 -0.858 . . . . 71.43 112.254 -170.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.501 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -78.89 -24.44 44.2 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.655 1.116 . . . . 74.13 110.967 176.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -65.84 -47.03 76.37 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 109.745 -0.465 . . . . 75.14 109.745 167.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.69 -39.66 77.66 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.952 0.901 . . . . 64.1 110.781 175.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 29.8 t0 -75.02 -42.93 56.32 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.198 0.999 . . . . 71.1 111.906 -172.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 61.6 ttt-85 -64.7 -41.7 95.83 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.1 -0.954 . . . . 71.14 109.719 178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -65.09 -34.9 79.51 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.186 -0.915 . . . . 71.32 110.806 172.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.56 -19.56 59.22 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.855 0.462 . . . . 73.52 111.491 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.63 -58.79 3.06 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.866 -0.79 . . . . 64.03 108.866 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . 0.555 HE22 HD23 ' A' ' 89' ' ' LEU . 1.9 mp0 -70.14 -46.72 64.13 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.587 0.755 . . . . 54.01 111.494 -175.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 75.3 mtp -96.86 36.25 1.43 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.572 0.749 . . . . 72.34 110.397 -178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 50.5 tp . . . . . 0 CA--C 1.547 0.832 0 C-N-CA 123.703 0.801 . . . . 65.14 110.702 -179.701 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.553 -0.166 . . . . 75.14 110.553 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -61.07 -41.01 95.83 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.885 0.74 . . . . 71.54 109.484 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.425 HD11 HD12 ' A' ' 42' ' ' LEU . 3.6 mm? -58.17 -52.11 66.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.303 0.641 . . . . 75.34 110.409 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -53.85 -38.67 64.91 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.135 0.574 . . . . 72.31 111.083 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.417 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.5 t-80 -65.88 -49.5 67.85 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 123.805 0.691 . . . . 75.3 110.49 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.96 -52.58 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 124.876 1.27 . . . . 71.21 111.477 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -64.71 -40.87 90.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.035 0.934 . . . . 70.34 110.693 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 55.3 m -62.75 -42.5 99.71 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.693 0.397 . . . . 72.22 110.75 176.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 79.6 mt -57.4 -56.65 19.09 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.37 0.419 . . . . 72.12 110.084 177.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.4 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -62.58 -35.7 92.18 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 124.279 0.987 . . . . 63.11 113.827 -176.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.447 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 4.5 tp-100 -70.38 -49.5 48.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 109.636 -0.505 . . . . 74.13 109.636 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.99 -33.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.564 0.746 . . . . 72.02 110.774 175.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.4 HD12 ' HA2' ' A' ' 11' ' ' GLY . 23.1 mt -54.61 -55.96 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.949 0.9 . . . . 64.5 109.768 173.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -60.39 -38.7 84.79 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 124.155 0.909 . . . . 71.42 111.686 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 13.5 mptt -60.84 -54.64 42.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.008 0.923 . . . . 63.23 111.918 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -79.48 -19.22 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.461 0.704 . . . . 62.22 111.989 -175.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.6 t -64.33 -17.81 64.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.365 1.066 . . . . 75.41 113.068 177.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -55.42 -20.63 12.82 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 123.961 0.905 . . . . 72.31 112.915 175.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -62.8 -29.87 71.04 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.408 0.683 . . . . 73.31 112.472 175.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.422 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 8.3 mmt -78.45 81.83 4.76 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.101 0.477 . . . . 44.11 110.679 -173.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -80.55 -34.51 35.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.139 -1.06 . . . . 60.32 108.139 169.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.45 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 85.7 m-85 -90.81 153.32 20.32 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 114.186 -1.37 . . . . 71.42 108.217 170.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m 57.81 70.99 0.61 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.369 1.08 . . . . 53.53 109.536 -166.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.427 ' H ' ' HD2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -75.08 -48.69 22.65 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 113.803 -1.544 . . . . 53.43 109.411 -170.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.0 mptp? -61.68 -37.37 83.84 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 109.416 -0.587 . . . . 75.21 109.416 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.77 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 16.0 mm-40 -66.25 -43.85 85.37 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 117.862 0.301 . . . . 51.33 111.16 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 52.7 t -66.78 -43.02 85.08 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.906 0.882 . . . . 73.12 111.874 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.3 mpt_? -80.93 -33.55 33.97 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.557 0.743 . . . . 72.43 111.033 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.511 ' NH2' ' HB2' ' A' ' 136' ' ' GLU . 25.6 tpt180 -73.16 -38.63 66.15 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.185 -0.672 . . . . 51.0 109.185 176.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.73 -46.33 90.11 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 123.815 0.697 . . . . 74.12 109.159 173.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.2 -46.22 93.07 Favored Glycine 0 C--N 1.349 1.298 0 O-C-N 123.879 0.737 . . . . 54.44 112.63 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -60.46 -52.82 63.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.453 0.701 . . . . 52.01 110.452 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.54 HH12 ' HB2' ' A' ' 106' ' ' SER . 16.3 mtt180 -58.81 -63.4 1.31 Allowed 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.094 0.871 . . . . 60.15 110.547 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 39' ' ' ILE . 55.8 t -50.93 -50.57 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.305 1.042 . . . . 70.05 111.942 -175.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -62.46 -41.54 98.83 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 123.369 0.418 . . . . 71.25 111.188 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.55 -23.55 72.12 Favored Glycine 0 N--CA 1.474 1.17 0 CA-C-N 116.325 -0.398 . . . . 61.5 113.34 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.571 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 27.6 mt -87.2 -46.98 9.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 54.2 111.301 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 35' ' ' VAL . 23.0 pt -80.47 -41.55 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 117.933 -1.032 . . . . 64.34 111.917 -170.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -54.77 -48.27 95.97 Favored Pre-proline 0 N--CA 1.497 1.891 0 N-CA-C 113.724 1.009 . . . . 75.43 113.724 -174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -54.76 -39.36 89.94 Favored 'Trans proline' 0 C--N 1.391 2.785 0 C-N-CA 122.1 1.866 . . . . 61.33 112.868 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 45' ' ' LEU . 4.2 mm? -77.08 -29.39 54.97 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.224 -0.898 . . . . 75.21 111.359 178.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -67.22 -38.14 84.76 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.323 0.649 . . . . 62.03 109.973 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 67.3 mtm -62.07 -50.77 70.65 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.779 0.675 . . . . 75.02 111.019 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 42' ' ' LEU . 4.4 pp -76.51 -22.77 54.0 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.698 0.399 . . . . 65.33 111.967 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -71.24 -41.15 70.51 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.608 0.763 . . . . 72.45 110.211 174.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 t70 . . . . . 0 N--CA 1.481 1.077 0 C-N-CA 123.909 0.884 . . . . 75.42 108.882 -177.912 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 N--CA 1.468 0.439 0 N-CA-C 108.12 -1.066 . . . . 61.33 108.12 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -62.74 -44.73 95.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 122.495 0.318 . . . . 71.01 110.875 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.86 -37.28 76.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.388 0.675 . . . . 64.04 111.147 175.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 2.8 tm? -70.94 -47.66 57.77 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 124.11 0.964 . . . . 64.24 109.392 -175.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.3 m -64.46 -40.57 95.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.08 0.862 . . . . 43.24 110.857 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.8 m -58.52 -49.11 78.58 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.788 0.835 . . . . 73.15 110.756 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.09 98.64 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.722 0.809 . . . . 53.13 111.0 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.6 mmt -67.84 -33.62 75.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.668 0.787 . . . . 74.12 111.14 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -73.27 -35.88 66.26 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.544 0.737 . . . . 64.35 110.751 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.278 0.631 . . . . 61.43 110.112 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.571 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 2.5 t80 -67.17 -45.91 75.56 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.116 1.366 . . . . 70.11 109.507 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.2 ttpp -58.32 -51.29 70.4 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.812 -1.54 . . . . 72.03 110.009 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.72 -43.2 76.3 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.177 0.923 . . . . 52.32 111.392 -178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.572 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.8 -42.63 99.26 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 114.984 -1.007 . . . . 74.51 111.639 177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -74.41 -25.8 59.68 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.931 0.492 . . . . 72.33 112.3 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 62.1 mt-10 -67.11 -44.04 80.95 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.619 0.724 . . . . 64.22 109.341 174.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.1 mt-10 -67.53 -43.18 81.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.509 -1.223 . . . . 62.24 111.01 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.57 -40.26 96.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.466 0.707 . . . . 62.2 111.23 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.42 -43.43 98.88 Favored 'General case' 0 C--N 1.351 0.64 0 O-C-N 124.235 0.959 . . . . 75.1 109.758 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.2 -33.34 86.98 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.555 -0.748 . . . . 62.34 113.89 175.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 26.0 mm-40 -63.69 -57.94 8.45 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.998 -0.371 . . . . 73.14 109.998 178.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.563 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -66.7 -20.13 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.62 0.6 . . . . 74.3 112.62 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.74 -49.56 75.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.104 -0.702 . . . . 72.23 109.104 171.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -80.83 -25.97 37.36 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 111.811 0.3 . . . . 74.14 111.811 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.563 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.7 m-30 -77.81 -5.21 50.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.595 0.758 . . . . 74.32 112.131 -178.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.8 p -55.91 -30.71 62.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.244 0.617 . . . . 74.42 110.178 173.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -81.76 107.55 14.58 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 108.657 -0.868 . . . . 62.43 108.657 167.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -68.26 -25.82 65.36 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.345 0.658 . . . . 75.2 110.749 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.7 p -71.23 -33.02 69.47 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 43.15 111.336 175.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.95 -40.57 98.08 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.566 0.746 . . . . 65.23 110.047 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.65 HG23 HD11 ' A' ' 97' ' ' LEU . 32.3 mt -57.87 -61.25 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.846 0 CA-C-N 114.83 -1.077 . . . . 73.23 109.911 175.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.99 -40.57 61.15 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.976 0.91 . . . . 72.24 111.971 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 47.3 tpt85 -58.92 -56.68 19.11 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.449 -1.25 . . . . 63.21 111.754 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -21.27 51.66 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 110.219 -0.289 . . . . 71.33 110.219 -177.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.505 HD23 HE22 ' A' ' 149' ' ' GLN . 17.3 tp -73.3 -40.81 64.24 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.932 0.893 . . . . 72.01 110.576 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -67.11 -23.92 65.88 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.026 0.441 . . . . 53.54 110.607 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.33 -0.26 41.5 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.591 1.156 . . . . 71.24 111.8 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.6 t . . . . . 0 N--CA 1.474 0.742 0 C-N-CA 123.279 0.632 . . . . 53.02 110.369 -176.252 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.6 HD13 ' HG2' ' A' ' 99' ' ' LYS . 3.1 mp . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 109.825 -0.435 . . . . 74.33 109.825 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.77 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.9 tp -62.97 -39.75 95.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.237 1.015 . . . . 74.31 111.096 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.403 ' H ' HG22 ' A' ' 96' ' ' ILE . 39.1 m-85 -103.56 17.74 23.42 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 114.354 -1.294 . . . . 72.42 111.016 -175.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 96' ' ' ILE . 2.1 tmtp? -35.45 -64.27 0.3 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 124.78 1.232 . . . . 74.52 113.571 -157.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 25.8 t70 -61.82 -48.84 78.77 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 124.044 0.84 . . . . 54.53 110.797 -175.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.19 -44.95 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.85 . . . . 74.32 111.268 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -75.43 -25.93 57.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.599 0.76 . . . . 72.12 110.221 -175.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.65 -38.64 89.91 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.827 -0.805 . . . . 74.24 108.827 170.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 100' ' ' ASP . 1.4 mptm? -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 118.855 -0.593 . . . . 72.04 110.846 172.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.5 mp -58.12 -43.76 87.38 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 119.275 0.943 . . . . 74.14 110.389 172.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.54 ' HB2' HH12 ' A' ' 34' ' ' ARG . 9.5 t -67.33 -51.62 50.16 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.421 0.688 . . . . 70.52 111.256 -175.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 14.0 t70 -69.26 -50.02 50.81 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.531 -1.213 . . . . 73.02 110.11 -174.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.56 -35.95 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 118.944 -0.55 . . . . 75.03 110.806 -178.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.5 t-105 -60.6 -48.52 81.39 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 118.373 0.533 . . . . 73.23 110.567 176.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.42 -37.08 84.41 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 118.931 -0.557 . . . . 75.45 110.961 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.5 mm-40 -61.42 -48.23 82.15 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.265 0.484 . . . . 52.22 111.398 175.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.0 tt -64.79 -51.93 59.55 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.294 1.438 . . . . 65.43 109.733 -175.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.9 t -60.78 -42.24 97.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.802 1.241 . . . . 71.23 111.538 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.2 -55.88 27.1 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 119.342 -0.361 . . . . 65.44 110.86 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 4.5 pp -61.53 -29.82 70.24 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.579 0.228 . . . . 71.1 111.571 -177.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.558 HD22 ' SD ' ' A' ' 122' ' ' MET . 58.9 mt -62.42 -53.63 52.01 Favored 'General case' 0 C--N 1.359 0.99 0 CA-C-N 115.813 -0.63 . . . . 71.53 111.126 171.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -68.88 -35.1 76.48 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.979 0.512 . . . . 73.41 111.839 -175.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.61 -58.68 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.183 0.593 . . . . 63.43 110.512 -177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -97.05 -56.42 2.56 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.354 0.502 . . . . 64.34 112.354 -171.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -71.46 -14.87 62.27 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 112.128 0.418 . . . . 71.35 112.128 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 60.53 23.53 13.22 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.842 1.257 . . . . 74.51 111.975 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.558 ' SD ' HD22 ' A' ' 116' ' ' LEU . 64.4 mtp -79.96 118.26 71.52 Favored Pre-proline 0 C--N 1.351 0.666 0 C-N-CA 124.408 1.083 . . . . 75.1 109.552 179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo . . . . . 0 C--N 1.372 1.81 0 C-N-CA 123.148 2.565 . . . . 62.34 111.882 -177.271 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 11.0 t90 . . . . . 0 N--CA 1.481 1.085 0 CA-C-O 120.473 0.178 . . . . 65.22 110.888 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.23 -20.63 65.71 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.793 0.837 . . . . 73.44 112.145 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 138' ' ' GLN . 67.3 mt-30 -77.68 -34.23 53.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.32 0.648 . . . . 70.44 110.27 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . 45.2 mt-10 -64.88 -42.19 95.01 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 109.236 -0.653 . . . . 73.44 109.236 173.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -56.52 -44.72 81.07 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.886 0.741 . . . . 74.14 111.836 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 2.5 pt20 -76.17 -30.7 58.19 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.387 0.429 . . . . 64.43 111.58 -176.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -65.63 -53.05 46.88 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.654 0.782 . . . . 74.13 110.253 174.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.8 -46.88 77.91 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 114.534 -1.212 . . . . 71.35 111.221 175.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.2 -29.26 68.07 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.821 0.849 . . . . 22.54 112.808 -177.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.36 -49.62 66.29 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.157 0.503 . . . . 64.21 109.988 175.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.7 -31.69 73.03 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.382 -1.281 . . . . 72.04 111.605 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.7 t0 -79.55 -41.44 27.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.058 0.943 . . . . 71.33 111.509 -175.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 53.8 ttt180 -66.6 -37.16 84.32 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.731 . . . . 64.24 109.629 176.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -68.7 -35.64 77.45 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.317 -0.856 . . . . 70.35 110.829 171.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -23.96 61.31 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.664 0.386 . . . . 63.14 111.172 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.3 OUTLIER -79.7 -60.82 2.2 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.31 0.644 . . . . 63.4 110.011 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . 0.505 HE22 HD23 ' A' ' 89' ' ' LEU . 2.0 mp0 -71.03 -45.35 64.06 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.841 0.456 . . . . 73.21 111.186 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ttm -99.88 60.38 1.09 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.016 -1.105 . . . . 44.2 108.016 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 30.9 tp . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.17 0.986 . . . . 72.22 109.311 179.531 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 . . . . . 0 CA--C 1.552 1.037 0 CA-C-O 119.547 -0.264 . . . . 71.52 111.669 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.21 -45.22 61.82 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.465 0.706 . . . . 73.13 110.314 172.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.0 mm? -65.06 -41.56 95.01 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 115.153 -0.93 . . . . 70.34 110.675 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -57.82 -46.55 84.54 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 109.605 -0.517 . . . . 65.41 109.605 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -60.79 -55.46 32.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.757 0.66 . . . . 71.12 110.859 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.7 mt -57.42 -53.95 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.724 0.809 . . . . 73.42 112.167 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.509 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -61.07 -44.34 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.301 1.04 . . . . 72.31 110.511 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 95.9 m -63.73 -46.38 85.64 Favored 'General case' 0 C--N 1.358 0.952 0 C-N-CA 122.88 0.472 . . . . 72.14 111.262 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.8 -46.28 87.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.466 0.706 . . . . 60.24 110.936 -178.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.419 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.2 -49.93 71.1 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 124.608 1.193 . . . . 64.55 111.966 178.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.4 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 70.8 mt-30 -56.09 -46.72 78.95 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.962 0.505 . . . . 70.3 111.365 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.2 -38.32 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.789 0.836 . . . . 73.3 111.15 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.25 -53.59 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.771 0.828 . . . . 62.24 110.197 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -60.73 -33.05 72.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.848 0.859 . . . . 74.54 111.43 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.7 mptm? -75.22 -53.17 9.25 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.293 0.637 . . . . 72.31 111.186 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.477 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 12.1 ptm180 -66.93 -30.44 70.58 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 111.753 0.279 . . . . 73.21 111.753 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.1 t -59.76 -17.89 38.93 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.861 1.264 . . . . 61.02 112.995 -175.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -53.32 -23.57 9.59 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.602 0.761 . . . . 60.34 112.332 173.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.72 -13.28 61.97 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.197 0.999 . . . . 71.54 112.066 -178.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.1 mmt -76.3 96.35 3.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.514 -0.551 . . . . 75.34 109.514 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -29.42 39.35 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.456 -0.942 . . . . 75.2 108.456 174.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.407 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 43.6 m-85 -99.97 175.99 5.58 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.439 1.096 . . . . 75.11 110.194 169.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' HG21 ' A' ' 85' ' ' ILE . 70.9 m 53.67 79.5 0.13 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.385 1.053 . . . . 64.11 110.138 -171.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -73.86 -61.21 1.93 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.551 -0.749 . . . . 75.25 109.591 -170.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 48.8 mttm -67.15 -39.52 86.55 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 114.416 -1.266 . . . . 74.3 111.781 -174.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.462 ' HG2' HH22 ' A' ' 30' ' ' ARG . 45.7 mt-30 -71.22 -31.45 67.6 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.07 0.548 . . . . 53.13 111.84 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 53.2 t -76.63 -40.79 48.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.315 0.646 . . . . 53.42 110.692 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 mtp-105 -65.39 -38.35 89.72 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.219 0.608 . . . . 74.24 110.657 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.629 HH22 ' HB2' ' A' ' 141' ' ' ALA . 6.5 mtp180 -66.44 -44.42 82.92 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.175 -0.917 . . . . 72.2 109.939 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 ' SG ' ' A' ' 18' ' ' CYS . 55.5 tp -56.08 -49.29 74.22 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.71 0.631 . . . . 72.33 110.776 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.36 -45.87 92.42 Favored Glycine 0 C--N 1.351 1.388 0 O-C-N 123.989 0.806 . . . . 53.5 112.166 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -60.93 -42.55 98.4 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.309 1.043 . . . . 74.52 111.49 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 57.1 mtt180 -59.22 -61.04 2.93 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.7 -0.852 . . . . 75.4 108.7 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.3 t -51.09 -49.04 29.74 Favored 'Isoleucine or valine' 0 C--N 1.353 0.75 0 O-C-N 125.47 1.731 . . . . 55.03 111.636 -175.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 97.1 mt -61.12 -43.61 98.62 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 124.097 0.873 . . . . 62.03 111.063 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.88 -25.59 74.18 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.553 0.533 . . . . 51.13 113.354 176.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.518 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 20.0 mt -82.89 -43.12 16.93 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.204 0.602 . . . . 62.12 111.127 -177.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.419 HG21 ' HA3' ' A' ' 11' ' ' GLY . 12.1 pt -79.07 -30.98 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.43 -0.795 . . . . 73.21 110.544 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 57.2 tptt -43.07 -59.45 3.11 Favored Pre-proline 0 N--CA 1.494 1.772 0 C-N-CA 124.346 1.058 . . . . 74.4 113.127 -178.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 26.0 Cg_exo -65.8 -31.62 47.98 Favored 'Trans proline' 0 C--N 1.392 2.835 0 C-N-CA 122.133 1.888 . . . . 74.42 112.609 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.4 mm? -79.44 -25.06 42.06 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.415 0.686 . . . . 74.12 110.768 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -73.01 -36.3 66.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.345 0.658 . . . . 74.14 109.324 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.7 mmt -63.79 -24.55 67.8 Favored 'General case' 0 N--CA 1.482 1.139 0 O-C-N 123.74 0.65 . . . . 64.33 110.529 175.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 77.2 mt -73.83 -64.01 1.09 Allowed 'General case' 0 C--N 1.355 0.814 0 N-CA-C 109.276 -0.639 . . . . 73.42 109.276 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -54.71 -34.65 62.71 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.182 0.808 . . . . 73.1 113.182 -167.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.478 0.928 0 C-N-CA 122.403 0.281 . . . . 74.44 111.7 176.972 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 110.326 -0.25 . . . . 52.0 110.326 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -58.85 -45.17 90.71 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.978 0.511 . . . . 70.32 111.126 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -70.79 -34.68 72.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.279 0.631 . . . . 65.41 111.867 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.562 HD22 HD13 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -59.82 -49.26 78.42 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.182 -1.044 . . . . 73.14 108.182 176.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -64.98 -35.18 80.36 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.482 1.113 . . . . 61.45 111.014 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.2 m -59.33 -48.26 82.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.845 0.458 . . . . 73.34 110.54 176.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.98 -40.6 94.07 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.833 0.708 . . . . 73.21 110.98 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.97 -41.36 97.91 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.542 0.737 . . . . 73.21 111.836 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -69.78 -39.1 76.83 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.444 0.698 . . . . 65.42 110.719 -178.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -65.76 -37.96 87.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.408 0.683 . . . . 75.22 110.884 176.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 1.7 t80 -70.05 -43.49 71.14 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.882 0.739 . . . . 73.22 109.969 -177.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -58.99 -50.26 74.76 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.669 1.188 . . . . 65.5 110.825 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.91 -41.42 97.9 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 124.019 0.824 . . . . 72.14 111.241 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.433 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -63.88 -38.88 92.73 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.88 0.737 . . . . 42.11 111.169 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.68 -43.71 92.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.084 0.554 . . . . 73.52 110.886 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.72 -34.02 76.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.451 0.701 . . . . 62.54 111.095 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 36.9 mm-40 -69.3 -42.93 74.78 Favored 'General case' 0 C--N 1.351 0.634 0 O-C-N 123.603 0.564 . . . . 72.14 111.349 175.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.48 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.066 0.546 . . . . 44.43 111.173 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -60.36 -44.54 95.49 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.17 0.988 . . . . 61.32 109.641 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -62.11 -36.73 93.37 Favored Glycine 0 C--N 1.347 1.183 0 O-C-N 124.239 0.962 . . . . 74.0 112.916 176.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 18.2 mm-40 -62.75 -56.93 13.13 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 117.273 0.536 . . . . 63.41 110.16 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.9 pt -65.56 -18.98 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 112.169 0.433 . . . . 54.31 112.169 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.477 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 27.2 tt0 -70.91 -39.91 72.45 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 122.691 0.396 . . . . 74.54 110.653 173.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 48.9 mttm -74.98 -30.23 61.12 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.899 0.381 . . . . 72.54 110.467 175.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.0 m-85 -81.36 0.03 39.12 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.662 0.785 . . . . 64.35 112.228 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.6 p -55.75 -34.79 65.52 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.82 0.819 . . . . 61.34 110.955 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.484 ' HB2' ' ND2' ' A' ' 84' ' ' ASN . 21.6 m-80 -93.67 113.5 25.6 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.164 -1.421 . . . . 54.42 107.164 168.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -69.76 -21.53 63.43 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.941 0.896 . . . . 74.52 110.843 -171.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.3 m -63.13 -33.46 75.5 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.917 0.887 . . . . 72.21 111.691 173.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 81' ' ' ASN . 88.3 m-20 -67.09 -38.3 85.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.264 0.626 . . . . 72.31 110.228 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 97' ' ' LEU . 52.2 mt -55.72 -60.86 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.967 0 O-C-N 124.082 0.864 . . . . 74.23 109.197 172.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 52.7 t -53.82 -37.78 63.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.08 0.952 . . . . 35.34 111.63 -177.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -58.78 -57.54 12.58 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.429 1.08 . . . . 44.55 111.033 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.51 -28.2 56.31 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 110.366 -0.235 . . . . 75.34 110.366 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.414 HD23 HE22 ' A' ' 149' ' ' GLN . 16.7 tp -68.43 -39.7 81.43 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.454 1.102 . . . . 74.5 110.934 -171.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.9 t -65.26 -31.25 72.31 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.626 0.579 . . . . 73.31 110.956 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.23 -1.26 31.58 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.833 0.853 . . . . 70.34 111.64 -177.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.471 0.608 0 C-N-CA 123.493 0.717 . . . . 70.43 111.139 -175.348 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.605 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 4.2 mp . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 107.696 -1.224 . . . . 62.25 107.696 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.675 HD11 HG23 ' A' ' 85' ' ' ILE . 10.9 tp -62.97 -29.6 70.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.062 0.945 . . . . 74.14 112.734 -172.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.441 ' H ' HG22 ' A' ' 96' ' ' ILE . 52.2 m-85 -120.33 8.63 10.85 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 117.999 -1.001 . . . . 71.45 111.211 -174.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.605 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 28.2 ttpt -35.68 -59.59 0.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 114.724 1.379 . . . . 44.34 114.724 -156.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 31.3 t70 -66.89 -42.98 84.61 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.63 0.772 . . . . 60.03 111.563 -175.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.59 -38.02 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.242 0.617 . . . . 65.32 110.179 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -80.27 -18.16 50.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.42 0.688 . . . . 61.42 110.233 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -73.68 -34.0 64.69 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.505 -0.924 . . . . 75.02 108.505 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 48.3 mttm -62.9 -46.47 87.68 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.482 -0.562 . . . . 72.14 109.482 170.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.433 HD22 ' HB1' ' A' ' 68' ' ' ALA . 3.8 mm? -56.23 -43.29 78.47 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 123.336 0.397 . . . . 63.25 110.902 173.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t -70.46 -34.95 73.01 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.332 0.653 . . . . 50.41 111.332 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 18.0 t70 -72.27 -55.53 7.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.982 0.913 . . . . 72.41 109.496 -176.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.87 -53.76 38.33 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 114.907 -1.042 . . . . 74.43 109.598 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -61.5 -37.97 85.61 Favored 'General case' 0 C--N 1.357 0.93 0 CA-C-O 118.364 -0.827 . . . . 75.2 112.831 -175.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.7 ptmt -65.39 -47.64 75.65 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.556 1.071 . . . . 73.2 108.921 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.03 -35.59 80.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 120.93 0.395 . . . . 60.1 110.899 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 7.3 tt -72.82 -44.42 61.5 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.803 1.241 . . . . 62.14 110.023 -173.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 31.1 t -67.4 -40.93 85.66 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.349 0.66 . . . . 74.12 109.444 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 92.5 mt -64.13 -39.74 94.68 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 123.504 0.502 . . . . 73.43 112.019 178.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.562 HD13 HD22 ' A' ' 58' ' ' LEU . 4.2 pp -73.88 -25.25 59.93 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.064 0.393 . . . . 71.13 110.515 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.571 HD13 ' SD ' ' A' ' 122' ' ' MET . 89.8 mt -69.67 -32.01 70.4 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 119.61 -0.233 . . . . 72.12 110.393 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 113' ' ' SER . 24.0 mm-40 -67.21 -52.35 42.22 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.803 0.441 . . . . 65.41 110.063 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -76.26 -60.31 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.326 -0.852 . . . . 63.3 111.384 -172.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.44 -56.23 7.12 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.763 0.425 . . . . 61.14 111.239 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -95.97 -11.55 26.37 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.267 0.84 . . . . 64.01 113.267 -168.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 55.28 71.41 0.54 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.809 0.844 . . . . 74.14 111.393 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.571 ' SD ' HD13 ' A' ' 116' ' ' LEU . 55.7 ttm -104.84 123.5 39.82 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 122.997 0.519 . . . . 71.32 110.115 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo . . . . . 0 C--N 1.365 1.396 0 C-N-CA 122.499 2.133 . . . . 75.05 112.396 175.595 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 36.2 m0 . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.373 0.13 . . . . 72.51 111.057 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.77 -19.93 60.29 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 112.51 0.559 . . . . 55.22 112.51 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -91.41 -60.68 1.83 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.868 0.867 . . . . 64.24 110.783 170.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.48 -62.68 1.52 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.785 1.234 . . . . 74.41 111.55 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.69 66.82 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.344 -1.298 . . . . 75.32 111.527 -176.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . 0.435 ' HA ' HD11 ' A' ' 96' ' ' ILE . 36.2 tt0 -72.34 -56.21 5.86 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.65 0.594 . . . . 72.12 111.601 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.422 ' O ' ' HB3' ' A' ' 142' ' ' ASP . 13.5 mm100 -69.22 -28.03 66.0 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.729 0.643 . . . . 74.54 111.407 -176.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -86.74 -28.46 23.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.952 -0.567 . . . . 43.54 110.593 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.629 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -72.34 -26.56 61.97 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 109.825 -0.435 . . . . 73.45 109.825 168.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . 0.422 ' HB3' ' O ' ' A' ' 139' ' ' GLN . 25.5 t70 -62.58 -52.66 62.53 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 123.933 0.77 . . . . 53.35 108.941 172.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -60.87 -37.27 81.56 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.603 1.19 . . . . 74.14 113.138 174.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.9 t0 -76.94 -46.28 24.74 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.022 0.378 . . . . 72.21 112.022 -174.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 78.5 ttt180 -63.41 -36.54 84.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.492 0.717 . . . . 64.42 110.487 173.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -57.33 -47.21 82.17 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 115.565 -0.743 . . . . 72.42 109.507 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.35 -32.8 74.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.168 0.917 . . . . 75.22 111.889 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 1.1 t80 -65.24 -43.14 92.36 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.237 0.615 . . . . 73.51 109.854 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . 0.414 HE22 HD23 ' A' ' 89' ' ' LEU . 1.9 mp0 -85.07 -20.34 30.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.136 0.574 . . . . 71.44 111.645 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -79.67 -62.69 1.61 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.03 0.532 . . . . 62.5 109.933 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 92.9 mt . . . . . 0 N--CA 1.489 1.511 0 C-N-CA 126.277 1.831 . . . . 72.14 113.619 -179.691 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 111.93 0.344 . . . . 61.23 111.93 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.96 -32.52 72.96 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.949 0.499 . . . . 72.22 111.338 177.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.479 ' O ' ' HB ' ' A' ' 7' ' ' ILE . 5.9 tt -68.3 -39.64 81.99 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.391 0.676 . . . . 52.14 109.363 174.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -68.13 -29.85 68.85 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.199 0.2 . . . . 45.52 110.802 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -70.59 -34.74 72.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 119.159 -0.448 . . . . 72.01 110.416 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.479 ' HB ' ' O ' ' A' ' 4' ' ' LEU . 61.2 mt -56.26 -47.88 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.679 0.792 . . . . 61.44 110.085 169.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.2 mm -59.36 -46.93 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 115.249 -0.887 . . . . 65.23 111.16 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 13' ' ' VAL . 87.2 m -60.8 -47.46 86.23 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.876 0.871 . . . . 62.31 110.757 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -57.81 -50.62 72.67 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 123.948 0.78 . . . . 72.43 110.76 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.06 -35.05 91.5 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.602 1.189 . . . . 43.35 113.487 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -72.39 -39.71 67.79 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 122.686 0.395 . . . . 65.4 110.194 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.48 HG12 HD21 ' A' ' 73' ' ' ASN . 98.6 t -72.96 -26.73 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.275 0.63 . . . . 44.41 110.257 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.583 HG21 HG21 ' A' ' 35' ' ' VAL . 26.4 mt -60.13 -53.49 47.94 Favored 'Isoleucine or valine' 0 C--N 1.361 1.068 0 N-CA-C 108.897 -0.779 . . . . 70.22 108.897 171.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -57.23 -41.09 78.86 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.321 1.013 . . . . 74.12 110.94 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -53.84 -59.64 4.36 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 124.169 0.918 . . . . 74.0 112.103 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -84.13 -16.56 43.16 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 113.703 1.001 . . . . 74.22 113.703 -172.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.51 -20.55 65.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.952 0.901 . . . . 74.11 111.952 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -58.46 -19.48 37.11 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 113.269 0.84 . . . . 65.5 113.269 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -67.19 -20.2 65.68 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.804 0.668 . . . . 70.02 112.804 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.3 mmt -79.12 85.4 5.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.251 0.548 . . . . 73.11 110.752 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -75.21 -33.87 61.43 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.609 -1.256 . . . . 55.31 107.609 166.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 46.4 m-85 -92.33 162.87 14.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 114.619 -1.173 . . . . 71.23 110.37 173.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.9 m 54.32 65.55 1.48 Allowed 'General case' 0 C--N 1.354 0.766 0 O-C-N 124.636 1.21 . . . . 44.31 109.637 -170.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 26' ' ' LYS . 49.4 pttt -53.22 -50.07 65.48 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 114.771 -1.104 . . . . 72.22 110.524 -174.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 25' ' ' LYS . 5.5 mtpm? -80.77 -25.43 37.95 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-O 118.349 -0.834 . . . . 53.52 111.322 -172.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.833 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 18.1 mm-40 -70.56 -36.33 73.57 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 119.196 0.907 . . . . 74.41 109.775 175.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.0 t -67.08 -45.81 76.17 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 44.52 110.359 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.84 -33.4 66.13 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.327 -0.851 . . . . 72.53 111.238 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.677 HH22 ' HB2' ' A' ' 141' ' ' ALA . 16.6 ttm180 -69.99 -45.81 66.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.462 -0.57 . . . . 72.23 109.462 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.438 HD21 HD13 ' A' ' 76' ' ' ILE . 41.8 tp -62.89 -46.14 89.26 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 124.114 0.884 . . . . 74.14 109.696 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.52 -47.3 91.4 Favored Glycine 0 C--N 1.346 1.086 0 O-C-N 123.723 0.639 . . . . 72.22 112.614 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -60.67 -49.74 76.32 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.71 0.804 . . . . 63.43 111.12 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.534 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 17.1 mtt180 -61.66 -64.12 1.04 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.754 -1.112 . . . . 70.41 109.955 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.583 HG21 HG21 ' A' ' 14' ' ' ILE . 61.2 t -56.07 -46.73 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 124.14 0.9 . . . . 74.53 111.929 -171.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.232 0.332 . . . . 73.44 110.502 176.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.0 -20.0 74.26 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 114.307 0.483 . . . . 71.21 114.307 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 49.5 mt -87.23 -46.82 9.38 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.504 0.722 . . . . 71.05 110.792 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 12.4 pt -77.75 -38.9 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-O 118.925 -0.56 . . . . 74.11 111.482 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -56.48 -46.06 99.86 Favored Pre-proline 0 N--CA 1.487 1.386 0 N-CA-C 113.795 1.035 . . . . 72.52 113.795 -171.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -54.44 -51.67 9.98 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 121.581 1.521 . . . . 74.11 111.276 172.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.77 -31.28 72.22 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 115.452 -0.794 . . . . 72.11 111.662 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -66.44 -60.5 2.68 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.748 0.819 . . . . 75.51 110.576 178.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.2 ptp -61.11 -36.33 79.43 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 124.111 0.882 . . . . 71.43 111.455 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.606 HD13 ' SD ' ' A' ' 122' ' ' MET . 82.9 mt -67.42 -47.59 69.78 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.504 0.721 . . . . 74.42 110.305 177.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -61.57 -35.07 76.75 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.811 0.694 . . . . 74.43 111.727 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 . . . . . 0 N--CA 1.483 1.214 0 C-N-CA 123.085 0.554 . . . . 61.32 111.437 -179.809 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 81.1 p . . . . . 0 N--CA 1.476 0.865 0 CA-C-O 120.89 0.376 . . . . 42.33 110.952 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.56 -33.95 76.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.127 -0.942 . . . . 73.13 110.228 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.612 ' HB3' HD22 ' A' ' 115' ' ' LEU . 35.7 mtmm -58.1 -55.18 38.26 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.589 0.756 . . . . 71.11 110.573 174.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.563 HD22 HD13 ' A' ' 115' ' ' LEU . 4.4 mm? -59.82 -49.38 77.92 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.646 0.778 . . . . 74.33 111.537 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.8 m -58.41 -50.42 73.74 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 123.931 0.769 . . . . 73.3 111.206 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.6 m -68.82 -36.51 78.31 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.319 0.648 . . . . 62.52 111.53 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -68.79 -44.24 74.0 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.645 -0.502 . . . . 63.34 109.645 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -40.33 96.66 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.987 -1.006 . . . . 64.23 111.44 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -66.83 -42.49 85.72 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.202 0.601 . . . . 73.11 111.538 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -69.15 -42.15 76.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.62 0.768 . . . . 73.25 111.027 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.413 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 20.1 t80 -71.03 -37.79 72.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.132 0.973 . . . . 73.44 110.102 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.5 ttpp -61.75 -51.19 69.37 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.289 -0.868 . . . . 73.01 109.077 174.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.66 -41.31 73.45 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.17 0.919 . . . . 75.15 111.713 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.597 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -62.27 -43.41 98.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.967 -1.015 . . . . 63.23 111.746 177.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.8 mt -75.79 -25.96 56.86 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.171 0.588 . . . . 61.24 112.214 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 52.8 mt-10 -65.74 -45.77 81.36 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.215 0.606 . . . . 74.11 109.404 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.17 -39.25 78.85 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.637 -1.165 . . . . 74.22 111.011 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.462 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -64.08 -43.37 95.62 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.5 0.5 . . . . 52.24 110.736 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.48 HD21 HG12 ' A' ' 13' ' ' VAL . 11.3 t-20 -61.59 -46.73 88.62 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 124.547 1.154 . . . . 62.12 109.734 179.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -61.22 -42.11 99.69 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.081 -0.963 . . . . 73.34 112.446 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -59.41 -53.15 61.44 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 118.931 -0.557 . . . . 65.42 111.667 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -65.71 -28.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 N-CA-C 112.446 0.536 . . . . 71.03 112.446 178.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -64.64 -33.13 75.22 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.444 0.298 . . . . 61.32 110.687 172.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 42.2 mttm -85.5 -28.09 25.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.021 0.529 . . . . 71.45 111.012 176.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.472 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.3 m-85 -76.67 -2.84 34.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.935 0.894 . . . . 61.14 112.135 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -57.69 -25.32 60.11 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.346 0.659 . . . . 73.0 110.378 170.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -84.46 107.29 16.63 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 107.712 -1.218 . . . . 61.54 107.712 164.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -72.91 -23.65 60.73 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.469 0.708 . . . . 63.12 110.736 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.2 p -68.73 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.128 0.971 . . . . 73.21 111.335 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -61.4 -41.6 97.4 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.79 0.836 . . . . 74.21 110.236 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 97' ' ' LEU . 39.3 mt -56.89 -60.15 2.31 Favored 'Isoleucine or valine' 0 C--N 1.354 0.794 0 CA-C-N 115.109 -0.95 . . . . 74.54 109.479 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.2 t -58.27 -34.51 70.58 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 123.964 0.79 . . . . 53.0 111.631 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -59.63 -56.45 21.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.977 1.311 . . . . 73.25 110.885 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.91 -22.23 42.99 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.853 -0.158 . . . . 75.24 110.583 -177.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.2 tp -76.27 -33.96 59.12 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.58 0.752 . . . . 64.34 111.081 -172.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.3 t -68.95 -25.05 64.36 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 110.065 -0.346 . . . . 61.3 110.065 173.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.82 17.62 22.29 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.433 1.093 . . . . 61.12 111.326 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 91.3 p . . . . . 0 C--N 1.359 0.999 0 N-CA-C 109.276 -0.638 . . . . 65.31 109.276 179.617 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp . . . . . 0 N--CA 1.478 0.962 0 N-CA-C 108.985 -0.746 . . . . 71.25 108.985 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.833 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.0 tp -60.6 -40.67 92.65 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.694 0.759 . . . . 44.15 111.968 -171.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.421 ' HB3' ' HB ' ' A' ' 101' ' ' VAL . 5.0 m-85 -112.02 38.03 2.8 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.992 -1.004 . . . . 73.42 108.528 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -39.49 -53.53 2.05 Favored 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 113.568 0.951 . . . . 74.12 113.568 -160.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 34.6 t70 -80.07 -40.7 27.09 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.372 0.669 . . . . 73.42 110.74 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.421 ' HB ' ' HB3' ' A' ' 98' ' ' PHE . 56.3 t -62.91 -54.43 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.644 0.777 . . . . 62.35 111.371 -177.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -69.45 -26.06 64.4 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.034 0.934 . . . . 70.33 111.213 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -35.75 77.14 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.105 0.412 . . . . 73.42 110.993 164.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.9 mttm -66.01 -44.79 83.72 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.221 -0.659 . . . . 74.41 109.221 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.8 mp -53.47 -44.89 69.31 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.354 0.409 . . . . 71.23 109.972 174.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.42 ' HA ' ' CZ3' ' A' ' 133' ' ' TRP . 21.1 m -62.88 -57.64 10.12 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.776 0.673 . . . . 75.31 112.108 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.1 t70 -72.43 -41.71 65.87 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 114.865 -1.061 . . . . 51.14 110.692 -169.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 51.4 t -74.2 -28.79 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 115.862 -0.608 . . . . 61.12 110.882 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.409 ' CD2' HD22 ' A' ' 38' ' ' LEU . 62.5 t-105 -67.83 -37.91 82.54 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.37 0.532 . . . . 72.43 110.439 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.7 mtpt -55.12 -52.73 62.33 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.523 -0.547 . . . . 75.11 109.523 173.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.49 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 39.7 mt-10 -53.74 -51.73 62.39 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 124.424 1.078 . . . . 71.31 111.028 174.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -66.06 -55.24 17.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.054 0.942 . . . . 73.02 109.651 -168.464 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.2 p -59.63 -40.34 87.32 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.394 0.678 . . . . 74.41 112.0 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.7 pp -64.08 -43.01 96.71 Favored 'General case' 0 C--N 1.37 1.457 0 CA-C-N 118.139 0.427 . . . . 71.53 110.839 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.612 HD22 ' HB3' ' A' ' 57' ' ' LYS . 4.2 pp -74.6 -20.99 59.71 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.476 0.547 . . . . 53.11 112.476 177.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 43.0 mt -69.42 -36.78 77.03 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 110.041 -0.355 . . . . 75.02 110.041 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.504 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.02 -38.34 44.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.321 0.648 . . . . 74.24 111.419 178.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 49.9 t -74.57 -62.63 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.339 0.656 . . . . 63.11 111.138 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -89.8 -57.11 2.98 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 122.383 -0.198 . . . . 64.01 111.382 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -67.12 -23.19 65.79 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.638 0.586 . . . . 62.21 111.899 -172.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 56.89 32.22 21.07 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.332 1.053 . . . . 72.03 111.848 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.606 ' SD ' HD13 ' A' ' 45' ' ' LEU . 41.4 mtm -91.29 146.17 32.91 Favored Pre-proline 0 N--CA 1.467 0.422 0 N-CA-C 108.818 -0.808 . . . . 72.45 108.818 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo . . . . . 0 C--N 1.371 1.748 0 C-N-CA 123.06 2.507 . . . . 71.11 112.287 -173.91 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.42 ' CZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 111.558 0.207 . . . . 74.05 111.558 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -32.33 73.82 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.697 0.399 . . . . 74.43 111.424 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 46.7 mt-30 -84.12 -37.87 21.43 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.775 0.83 . . . . 75.34 110.838 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.85 -52.65 64.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.42 1.088 . . . . 74.43 110.73 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.69 -37.28 86.02 Favored 'General case' 0 C--O 1.239 0.506 0 O-C-N 124.665 1.228 . . . . 65.33 112.907 -174.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.73 -48.68 63.18 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 109.922 -0.399 . . . . 75.24 109.922 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -63.37 -37.9 89.08 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.298 0.571 . . . . 74.13 111.441 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.13 -49.54 76.82 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.408 1.083 . . . . 55.51 109.722 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.677 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.51 -21.14 59.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.074 -0.966 . . . . 72.12 112.052 -178.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -64.81 -54.41 31.62 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.89 -0.781 . . . . 74.3 108.89 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.27 -39.35 92.49 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.269 0.981 . . . . 71.12 110.502 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.467 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 39.5 t0 -74.37 -48.52 27.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.661 -0.699 . . . . 70.54 112.163 -174.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 36.6 ttt-85 -65.65 -34.37 78.06 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.527 -0.546 . . . . 75.35 109.527 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -57.96 -48.68 79.25 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 123.603 0.565 . . . . 75.51 109.648 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.58 77.58 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.885 0.741 . . . . 73.23 111.8 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.9 OUTLIER -72.98 -49.18 30.56 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.612 0.57 . . . . 75.02 110.448 -178.722 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -81.55 -10.68 59.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.757 -0.656 . . . . 72.05 111.765 -172.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -96.24 -59.82 1.75 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.144 -1.058 . . . . 63.04 108.144 173.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.944 0 C-N-CA 125.957 1.703 . . . . 61.53 112.341 174.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 . . . . . 0 N--CA 1.476 0.851 0 N-CA-C 110.179 -0.304 . . . . 74.22 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 95.7 m-20 -58.45 -46.69 86.05 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.667 -0.697 . . . . 75.04 110.342 174.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 8' ' ' ILE . 42.6 mt -63.78 -40.49 96.8 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.863 0.727 . . . . 54.21 111.134 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -59.52 -48.42 81.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.762 -0.829 . . . . 62.51 108.762 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -66.08 -49.12 68.69 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-O 118.901 -0.571 . . . . 73.13 111.118 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.2 mt -54.42 -47.65 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.831 0.852 . . . . 62.14 111.275 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 4' ' ' LEU . 20.8 mm -66.78 -46.74 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.166 -0.925 . . . . 74.1 110.958 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -63.19 -44.0 96.59 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.536 0.522 . . . . 71.53 110.646 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.8 mt -55.49 -58.93 5.73 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.41 0.684 . . . . 72.54 109.835 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.81 -38.33 95.78 Favored Glycine 0 C--N 1.348 1.245 0 O-C-N 124.443 1.089 . . . . 61.24 114.609 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -70.98 -47.65 57.72 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 123.192 0.597 . . . . 61.05 110.259 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.44 HG12 ' HD2' ' A' ' 17' ' ' ARG . 90.6 t -64.48 -31.35 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 115.631 -0.713 . . . . 71.2 110.01 174.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.582 HG12 HD11 ' A' ' 76' ' ' ILE . 14.5 mt -59.02 -49.89 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.946 0.899 . . . . 35.42 109.712 174.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -60.44 -42.49 96.21 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 123.946 0.779 . . . . 74.53 111.322 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -67.11 -58.04 5.64 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.309 0.381 . . . . 73.52 111.456 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.44 ' HD2' HG12 ' A' ' 13' ' ' VAL . 1.4 ptm180 -72.07 -19.78 61.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.742 0.817 . . . . 71.42 112.992 -167.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 35.1 t -61.66 -16.04 45.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.919 0.888 . . . . 61.4 112.059 176.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -55.01 -12.81 0.92 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.006 1.113 . . . . 74.42 114.006 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -66.24 -18.73 65.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.381 0.673 . . . . 74.32 112.609 176.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 7.7 mmt -70.55 93.64 0.92 Allowed 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.081 0.467 . . . . 75.51 110.716 -175.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.569 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 11.3 mmmm -68.76 -43.93 74.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.016 0.926 . . . . 73.11 110.252 171.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -101.97 175.05 5.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.833 -1.531 . . . . 55.34 109.546 166.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.494 ' SG ' HG21 ' A' ' 85' ' ' ILE . 83.5 m 58.52 45.04 16.99 Favored 'General case' 0 C--O 1.243 0.735 0 O-C-N 124.095 0.872 . . . . 71.33 110.844 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -74.37 -45.23 48.3 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 114.627 -1.169 . . . . 72.42 110.658 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.9 mtpm? -65.07 -33.5 76.17 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.07 -0.715 . . . . 75.1 109.07 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.463 ' HB2' ' OD1' ' A' ' 144' ' ' ASP . 3.1 tp-100 -55.41 -47.02 76.56 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 123.893 0.746 . . . . 64.0 110.492 170.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 42.5 t -73.98 -21.97 59.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.201 1.0 . . . . 74.52 112.031 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -45.78 53.73 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.426 0.691 . . . . 64.45 109.739 174.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.448 ' NH2' ' HB2' ' A' ' 141' ' ' ALA . 21.9 ttp85 -75.33 -39.32 59.54 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.456 -0.793 . . . . 71.54 110.856 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.7 tp -62.86 -44.44 96.13 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.826 -0.805 . . . . 71.41 108.826 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.21 -52.67 47.98 Favored Glycine 0 C--N 1.349 1.267 0 O-C-N 124.384 1.053 . . . . 74.42 112.025 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -69.45 -34.12 73.93 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.092 0.557 . . . . 54.33 112.424 -177.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.656 HH12 ' HB2' ' A' ' 106' ' ' SER . 14.4 mtt180 -65.45 -58.81 4.92 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.092 -0.707 . . . . 61.3 109.092 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 39' ' ' ILE . 53.3 t -55.89 -44.81 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 124.435 1.084 . . . . 72.14 111.279 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.476 HD23 HD11 ' A' ' 39' ' ' ILE . 75.6 mt -62.14 -38.83 90.46 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.643 0.589 . . . . 63.45 110.666 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -71.89 -20.5 78.83 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.803 -0.443 . . . . 73.34 113.563 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 60.8 mt -85.71 -45.98 11.14 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.044 0.537 . . . . 60.45 111.137 177.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.476 HD11 HD23 ' A' ' 36' ' ' LEU . 14.3 pt -78.34 -43.22 26.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 118.869 -0.586 . . . . 71.44 110.904 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -52.4 -53.65 50.83 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 114.37 1.248 . . . . 72.22 114.37 -173.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.35 -32.64 81.37 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.768 1.645 . . . . 72.01 112.459 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 46' ' ' GLN . 4.3 mm? -75.16 -37.01 61.48 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.757 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HG3' HD12 ' A' ' 8' ' ' ILE . 78.6 mt-10 -67.06 -40.5 87.09 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.585 1.154 . . . . 75.42 111.25 -177.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.0 mmt -60.67 -40.28 91.52 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.984 0.803 . . . . 75.11 110.542 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.9 mt -80.7 -26.33 37.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.615 0.766 . . . . 75.35 111.481 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -74.76 -29.22 61.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.106 0.962 . . . . 63.23 109.942 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.306 0.642 . . . . 75.11 110.899 175.75 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 43.6 t . . . . . 0 C--O 1.242 0.682 0 N-CA-C 109.806 -0.442 . . . . 72.42 109.806 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.41 -27.85 65.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.69 -0.687 . . . . 44.14 110.602 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -74.2 -30.54 62.25 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.859 0.464 . . . . 71.24 111.028 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.516 ' HG ' ' HB3' ' A' ' 55' ' ' SER . 59.1 mt -69.46 -41.77 75.78 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.437 0.461 . . . . 65.34 109.978 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.4 m -61.14 -49.0 79.04 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 124.181 0.925 . . . . 70.1 109.933 175.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 79.9 m -60.98 -40.43 93.43 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.75 0.656 . . . . 74.52 111.24 178.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -62.29 -50.11 72.97 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.684 0.794 . . . . 74.25 110.854 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.6 mmt -72.63 -19.38 61.46 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 115.271 -0.877 . . . . 70.31 112.34 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -78.22 -44.12 26.51 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 122.916 0.486 . . . . 61.43 110.248 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -60.6 -46.18 91.2 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.191 0.996 . . . . 74.11 109.914 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.9 t80 -65.83 -50.92 62.89 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 114.569 -1.196 . . . . 53.02 109.444 -176.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.495 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 ttpm? -54.45 -46.57 73.31 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.455 0.702 . . . . 71.41 111.065 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.99 -43.71 94.99 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 124.038 0.836 . . . . 74.22 111.17 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.57 -39.2 88.36 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.632 -0.713 . . . . 64.11 111.546 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -65.64 -34.15 77.55 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.22 1.008 . . . . 71.01 111.299 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 80.9 mm-40 -61.06 -49.7 76.29 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.313 0.645 . . . . 64.33 109.283 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 33.7 mt-10 -59.32 -44.19 92.61 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.291 -1.322 . . . . 74.33 111.032 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.55 -42.98 99.88 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 123.914 0.759 . . . . 74.55 111.34 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -61.47 -36.42 80.39 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.812 0.695 . . . . 72.52 110.101 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -70.2 -36.72 71.43 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 114.83 -1.077 . . . . 65.44 112.328 177.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 11.5 mm-40 -62.63 -51.43 67.31 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 122.881 0.472 . . . . 52.45 109.774 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.582 HD11 HG12 ' A' ' 14' ' ' ILE . 2.3 pt -74.63 -19.39 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 112.566 0.58 . . . . 73.0 112.566 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.79 -40.63 93.35 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.606 -0.516 . . . . 71.3 109.606 167.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 77.1 mttt -74.77 -45.42 43.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.498 0.719 . . . . 65.11 110.616 175.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.56 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.5 m-30 -73.32 -4.28 32.32 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.116 0.966 . . . . 65.14 112.542 -173.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.9 p -57.33 -32.12 66.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.083 0.553 . . . . 72.54 110.234 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -84.43 118.8 24.49 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.149 -0.932 . . . . 72.44 109.265 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.569 ' HG2' ' HB2' ' A' ' 22' ' ' LYS . 4.1 mpt_? -74.14 -31.72 62.86 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.429 1.092 . . . . 74.45 110.046 -176.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.7 m -64.93 -36.05 83.14 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.813 -1.085 . . . . 74.31 111.04 174.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.4 -40.7 97.92 Favored 'General case' 0 C--O 1.252 1.185 0 C-N-CA 123.436 0.695 . . . . 74.42 110.532 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 97' ' ' LEU . 21.8 mt -58.91 -55.48 23.08 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 O-C-N 124.133 0.895 . . . . 75.21 109.536 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.7 t -56.22 -40.03 73.41 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.862 0.726 . . . . 65.14 111.911 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.8 -46.09 91.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.92 0.888 . . . . 55.13 111.452 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.28 -22.96 30.54 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 119.552 -0.261 . . . . 73.22 110.648 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 tp -73.3 -36.57 66.3 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.85 0.86 . . . . 75.31 110.662 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -74.65 -14.49 60.76 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.119 -0.946 . . . . 64.22 110.28 175.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -108.82 11.15 26.4 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.541 1.136 . . . . 73.42 110.163 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.7 t . . . . . 0 C--N 1.354 0.787 0 C-N-CA 124.035 0.934 . . . . 32.43 108.932 177.769 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.402 ' N ' HD12 ' A' ' 96' ' ' ILE . 2.7 mp . . . . . 0 CA--C 1.539 0.53 0 N-CA-C 109.133 -0.692 . . . . 74.51 109.133 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.537 HD11 HG23 ' A' ' 85' ' ' ILE . 12.0 tp -60.68 -30.87 70.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.968 1.307 . . . . 72.01 111.875 -175.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -111.65 13.06 21.21 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.679 -1.153 . . . . 74.11 111.423 -175.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -37.15 -57.86 0.84 Allowed 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 114.512 1.301 . . . . 73.23 114.512 -159.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.476 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 16.3 t70 -54.84 -62.44 1.66 Allowed 'General case' 0 N--CA 1.479 0.983 0 O-C-N 124.432 1.083 . . . . 74.43 110.749 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.03 -49.04 85.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 CA-C-N 114.903 -1.044 . . . . 73.55 111.676 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.7 -28.62 67.01 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.344 0.658 . . . . 65.53 111.331 -175.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -69.65 -34.17 73.64 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.366 -0.605 . . . . 74.13 109.366 172.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.1 mtpt -66.74 -42.64 85.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 119.148 -0.453 . . . . 71.31 110.873 174.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.519 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -59.83 -40.11 87.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 109.762 -0.458 . . . . 75.54 109.762 171.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.656 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.6 t -66.86 -42.53 85.52 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.765 0.666 . . . . 61.33 111.758 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -70.14 -47.63 60.88 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.659 0.783 . . . . 73.4 109.856 -177.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 45.6 t -72.88 -21.7 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.171 -0.922 . . . . 75.24 110.873 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.417 ' HA ' ' HB2' ' A' ' 112' ' ' LEU . 42.5 t-105 -78.54 -35.24 46.44 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 118.469 0.577 . . . . 74.24 110.855 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -57.71 -52.52 65.1 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.616 -0.883 . . . . 70.41 108.616 172.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.488 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 49.7 mt-10 -57.69 -49.3 76.95 Favored 'General case' 0 C--N 1.351 0.631 0 CA-C-N 114.359 -1.291 . . . . 65.2 110.261 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.5 OUTLIER -54.75 -60.5 3.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.512 1.132 . . . . 75.51 109.444 -174.503 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 84.4 p -59.18 -37.19 76.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.269 -0.878 . . . . 64.42 111.501 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.5 -57.29 8.6 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 111.922 0.341 . . . . 72.35 111.922 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 3.6 pp -66.28 -35.28 79.99 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-N 117.982 0.355 . . . . 72.52 111.6 -175.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.546 HD22 ' SD ' ' A' ' 122' ' ' MET . 94.1 mt -67.82 -50.94 53.96 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 123.183 0.593 . . . . 74.4 110.57 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.16 -45.71 69.36 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.118 0.485 . . . . 51.33 112.062 -173.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 94.0 t -84.76 -42.41 16.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-N 115.378 -0.828 . . . . 75.0 111.39 -171.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.5 -57.75 2.31 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 109.47 -0.567 . . . . 41.31 109.47 -175.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -11.85 59.89 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 123.521 0.729 . . . . 72.32 111.308 -174.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 65.57 44.15 3.11 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 125.259 1.424 . . . . 60.52 112.017 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.546 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.5 mtp -110.5 112.63 56.56 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.49 1.116 . . . . 64.3 109.8 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo . . . . . 0 C--N 1.372 1.763 0 C-N-CA 122.887 2.391 . . . . 71.32 112.061 -177.807 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.513 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 5.8 t90 . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 111.344 0.127 . . . . 73.42 111.344 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.22 -39.84 20.41 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.736 0.814 . . . . 63.55 111.491 173.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -67.74 -34.31 76.58 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.857 0.863 . . . . 62.33 111.518 -173.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.72 -35.08 70.19 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.47 -1.241 . . . . 74.51 111.024 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.66 -43.45 89.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.157 0.583 . . . . 73.5 111.557 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.47 -59.81 4.3 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.941 0.776 . . . . 74.14 110.259 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.41 -54.18 48.64 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.197 0.936 . . . . 64.53 111.846 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.41 -49.86 75.18 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.195 0.934 . . . . 73.33 110.857 -173.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.448 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . . . -66.71 -31.28 71.84 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 124.159 0.912 . . . . 71.15 111.432 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.27 -52.66 62.81 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 123.636 0.585 . . . . 73.4 110.12 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.27 -36.08 77.0 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.263 0.977 . . . . 71.4 111.458 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.9 t70 -75.73 -50.21 15.98 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.371 1.068 . . . . 72.12 112.045 -172.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -66.03 -33.34 75.59 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.148 -0.686 . . . . 75.22 109.148 175.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -67.35 -32.23 73.03 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.048 0.539 . . . . 62.22 109.988 174.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.59 -21.86 60.2 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.244 0.618 . . . . 64.32 111.335 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -54.91 12.12 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.394 -0.595 . . . . 74.22 109.394 169.303 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.56 -47.52 85.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.386 0.674 . . . . 70.31 111.565 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 40.6 ttm -84.76 -72.74 0.46 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.599 0.76 . . . . 43.34 109.441 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 35.5 tp . . . . . 0 CA--C 1.551 0.988 0 C-N-CA 125.347 1.459 . . . . 53.02 112.331 -178.02 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 110.605 -0.146 . . . . 72.34 110.605 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.636 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 16.4 m120 -59.15 -59.7 5.04 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 123.891 0.745 . . . . 65.11 109.934 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.486 ' O ' HG12 ' A' ' 8' ' ' ILE . 56.8 mt -61.91 -39.53 92.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 124.29 0.994 . . . . 72.22 112.165 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.28 -48.06 81.66 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.431 0.692 . . . . 60.41 109.91 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -72.38 -41.57 66.2 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-O 118.766 -0.635 . . . . 55.43 111.528 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.6 mt -52.56 -49.26 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.648 0.779 . . . . 74.42 110.673 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 4' ' ' LEU . 28.6 mm -71.69 -41.53 71.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 114.685 -1.143 . . . . 63.53 111.202 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -61.51 -59.12 5.72 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 122.893 0.477 . . . . 73.33 110.053 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.411 ' O ' HG13 ' A' ' 14' ' ' ILE . 27.2 mt -52.06 -49.4 63.55 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.309 1.044 . . . . 64.04 111.517 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.49 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -64.08 -39.05 96.83 Favored Glycine 0 C--N 1.351 1.383 0 O-C-N 123.955 0.785 . . . . 44.41 114.081 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -69.47 -44.26 71.55 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 109.284 -0.636 . . . . 72.52 109.284 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.467 HG12 ' HD2' ' A' ' 17' ' ' ARG . 69.5 t -61.88 -31.35 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.2 1.0 . . . . 74.21 111.013 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.507 HG21 HG21 ' A' ' 35' ' ' VAL . 68.3 mt -61.03 -53.26 51.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 109.047 -0.723 . . . . 70.34 109.047 172.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -58.33 -30.61 66.84 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 123.884 0.74 . . . . 72.4 112.142 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -76.45 -51.44 11.78 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.893 0.477 . . . . 73.32 111.672 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.467 ' HD2' HG12 ' A' ' 13' ' ' VAL . 9.7 ptm180 -84.47 -19.53 33.21 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.977 0.511 . . . . 74.14 112.235 -169.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.521 ' SG ' HD23 ' A' ' 31' ' ' LEU . 21.8 t -71.17 -19.84 62.36 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.499 0.72 . . . . 74.04 110.413 177.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -63.88 -13.17 42.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.284 0.634 . . . . 74.52 111.675 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -28.54 70.14 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.491 0.717 . . . . 65.22 110.247 174.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.6 mmt -70.31 89.24 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.126 0.571 . . . . 74.01 110.138 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -77.81 -24.01 48.9 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.299 -1.0 . . . . 64.12 108.299 170.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.536 ' HD1' ' HG2' ' A' ' 82' ' ' ARG . 83.8 m-85 -104.23 171.79 7.15 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.624 1.17 . . . . 74.33 109.461 167.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.649 ' SG ' HG21 ' A' ' 85' ' ' ILE . 57.9 m 53.01 49.92 19.1 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 124.093 0.87 . . . . 61.5 110.936 -175.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 51.1 pttt -61.5 -49.68 75.78 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 113.726 -1.579 . . . . 72.12 111.904 -174.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.574 ' HB3' ' HB2' ' A' ' 140' ' ' ASP . 28.6 mmtp -67.31 -45.26 77.05 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.544 0.337 . . . . 71.03 111.648 -174.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.82 -33.14 75.16 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.114 0.565 . . . . 74.4 110.999 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 21.5 t -75.72 -38.51 58.5 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.938 0.895 . . . . 72.41 111.849 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 25' ' ' LYS . 50.9 mtp85 -66.86 -41.8 86.75 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.798 -0.445 . . . . 73.14 109.798 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 32.3 ttp85 -63.04 -47.83 81.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.32 -0.854 . . . . 72.31 110.84 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.521 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.2 tp -55.08 -57.73 10.52 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.677 0.61 . . . . 70.22 110.776 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -42.95 98.46 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.061 0.85 . . . . 71.33 113.571 -177.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -60.02 -46.39 89.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.314 0.646 . . . . 65.25 111.514 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.515 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 70.2 mtt-85 -61.55 -53.83 51.16 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.837 0.71 . . . . 75.42 110.333 178.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.507 HG21 HG21 ' A' ' 14' ' ' ILE . 77.1 t -53.62 -43.54 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 124.168 0.918 . . . . 71.45 111.415 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 39' ' ' ILE . 72.5 mt -63.4 -46.16 87.69 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 123.695 0.622 . . . . 63.41 111.147 177.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.94 -22.81 65.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.084 -0.507 . . . . 52.32 113.31 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.573 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 36.6 mt -87.0 -42.55 13.02 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.452 0.701 . . . . 64.2 112.546 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 36' ' ' LEU . 18.7 pt -80.94 -40.14 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 112.096 0.406 . . . . 73.44 112.096 -172.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -57.55 -44.04 99.29 Favored Pre-proline 0 N--CA 1.486 1.374 0 N-CA-C 114.257 1.206 . . . . 70.35 114.257 -173.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -55.94 -31.84 83.32 Favored 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 122.325 2.016 . . . . 60.11 112.609 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.447 HD13 HD21 ' A' ' 45' ' ' LEU . 3.3 mm? -83.25 -29.87 28.1 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.044 -0.526 . . . . 73.44 110.383 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.54 -31.84 72.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.985 0.514 . . . . 62.43 110.837 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.5 mtm -65.89 -45.84 80.55 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 123.423 0.452 . . . . 63.04 111.556 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 HD13 ' A' ' 42' ' ' LEU . 4.3 pp -76.35 -26.97 56.27 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.277 0.231 . . . . 73.12 111.167 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -64.3 -42.49 96.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.121 0.969 . . . . 72.13 109.704 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 . . . . . 0 N--CA 1.475 0.824 0 CA-C-N 114.475 -1.239 . . . . 45.43 110.599 175.603 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.3 t . . . . . 0 CA--C 1.55 0.943 0 N-CA-C 110.0 -0.37 . . . . 64.44 110.0 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -54.22 -56.9 13.76 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.389 0.676 . . . . 72.32 110.147 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE3' ' HG3' ' A' ' 119' ' ' GLU . 47.0 pttt -68.77 -31.24 70.13 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.278 -0.874 . . . . 64.34 112.639 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.442 HD22 HD13 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -65.88 -55.74 15.44 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 108.702 -0.851 . . . . 71.23 108.702 -178.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 m -67.5 -36.05 80.33 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.2 -0.909 . . . . 74.43 111.372 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 100.0 m -62.31 -45.99 90.74 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 123.266 0.354 . . . . 62.44 110.962 177.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.78 94.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 123.571 0.544 . . . . 63.01 110.459 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.636 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 24.8 mmt -68.38 -25.97 65.33 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-N 115.588 -0.733 . . . . 63.22 112.252 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -75.7 -45.65 35.63 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.788 0.835 . . . . 73.42 110.269 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -62.88 -42.42 99.76 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.261 1.025 . . . . 61.21 110.245 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.573 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 6.3 t80 -67.03 -52.57 40.79 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 114.903 -1.044 . . . . 74.14 109.297 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.61 -47.12 63.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.41 1.084 . . . . 73.43 110.635 177.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.3 90.77 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.982 0.801 . . . . 42.04 111.486 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -65.19 -38.37 90.27 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.832 0.853 . . . . 65.11 111.512 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -63.37 -35.16 79.47 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.829 0.852 . . . . 71.12 111.046 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -68.69 -38.78 80.59 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.86 0.464 . . . . 74.22 111.171 175.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -59.24 -49.32 78.29 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 123.478 0.486 . . . . 74.14 109.954 176.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.74 -52.16 66.66 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.222 0.951 . . . . 41.42 111.634 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.44 -45.61 80.7 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.582 1.153 . . . . 73.12 111.758 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.38 -38.83 91.49 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.81 -1.086 . . . . 52.31 112.874 -176.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -76.84 -37.26 55.97 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.221 -0.895 . . . . 62.12 112.183 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -65.38 -32.53 58.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.492 1.042 . . . . 64.44 110.505 171.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.66 -47.5 84.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.323 -0.621 . . . . 63.4 109.323 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -71.6 -27.94 63.47 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.085 0.554 . . . . 44.11 112.248 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.77 4.51 36.58 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.743 0.817 . . . . 74.32 111.886 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.7 p -58.96 -26.44 64.43 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.019 0.438 . . . . 51.43 111.201 175.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -79.23 108.15 12.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.274 -1.01 . . . . 75.44 108.274 165.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.536 ' HG2' ' HD1' ' A' ' 23' ' ' TYR . 2.3 mpt_? -71.34 -24.08 62.04 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.28 0.632 . . . . 75.03 109.924 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.9 m -67.43 -35.74 79.85 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.724 0.81 . . . . 60.04 111.246 172.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.85 -41.0 99.18 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.051 0.94 . . . . 73.14 110.067 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 24' ' ' CYS . 46.8 mt -59.73 -59.08 4.49 Favored 'Isoleucine or valine' 0 C--N 1.352 0.715 0 CA-C-N 114.754 -1.112 . . . . 75.23 109.671 175.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.46 -33.48 65.95 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.176 0.59 . . . . 74.41 111.999 -178.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -60.04 -53.66 55.23 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.36 1.064 . . . . 70.14 111.258 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -77.96 -26.79 48.99 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 122.306 -0.246 . . . . 70.34 110.458 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.537 ' HG ' ' HG2' ' A' ' 145' ' ' ARG . 10.5 tp -72.7 -36.51 67.86 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.811 0.844 . . . . 75.33 110.951 -169.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.7 t -67.53 -30.67 70.38 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.664 -0.698 . . . . 74.54 110.605 175.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.25 -3.48 57.78 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.142 0.977 . . . . 51.12 110.936 177.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.473 0.702 0 C-N-CA 124.095 0.958 . . . . 63.44 110.485 177.88 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 22.2 mm . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 108.464 -0.939 . . . . 73.42 108.464 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -36.99 -54.17 0.95 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 125.714 1.606 . . . . 61.1 112.232 -178.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 52.9 m-85 -128.49 42.37 3.33 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 114.97 -1.014 . . . . 74.25 112.006 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.566 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 4.9 tmtm? -58.58 -61.1 2.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 119.512 1.051 . . . . 71.24 109.916 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.83 -41.03 92.29 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.287 -0.869 . . . . 54.34 111.626 -174.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.7 t -67.86 -43.63 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 123.513 0.508 . . . . 72.3 110.851 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.427 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 19.4 t30 -61.41 -38.88 88.72 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.563 -0.744 . . . . 74.51 110.269 174.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -31.89 72.8 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.033 0.533 . . . . 72.44 109.801 177.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.81 -56.68 10.63 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.154 0.582 . . . . 74.42 109.878 174.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.8 mp -55.3 -38.87 69.22 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.688 0.618 . . . . 40.3 111.008 178.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.2 t -73.66 -49.07 27.75 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.527 0.731 . . . . 73.52 111.888 -174.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.41 -48.59 74.83 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.44 0.696 . . . . 74.02 109.674 -177.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.1 t -64.52 -37.12 79.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 CA-C-N 114.968 -1.015 . . . . 74.52 110.516 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.42 ' HZ3' HD21 ' A' ' 42' ' ' LEU . 61.2 t-105 -60.97 -38.65 86.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.56 0.344 . . . . 75.44 111.497 176.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.0 -56.9 16.3 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.118 -0.697 . . . . 74.4 109.118 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -55.27 -44.69 75.84 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.199 0.937 . . . . 70.32 111.16 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.427 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.4 tt -69.82 -53.4 18.38 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.29 1.436 . . . . 74.43 110.796 -171.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.5 t -63.64 -36.02 82.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.371 0.668 . . . . 65.4 110.998 -179.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.54 -53.54 54.96 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.563 0.539 . . . . 70.4 111.155 176.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.442 HD13 HD22 ' A' ' 58' ' ' LEU . 3.9 pp -70.05 -24.42 63.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.089 -0.382 . . . . 71.12 111.796 -177.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.17 -43.14 71.45 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.297 0.239 . . . . 62.24 111.149 173.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.54 -23.06 40.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.509 0.559 . . . . 70.03 112.509 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.96 -50.13 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.407 0.283 . . . . 53.32 111.203 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.454 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 24.8 mm-40 -81.34 -56.76 3.84 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.924 0.392 . . . . 74.21 110.883 -176.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -86.72 -1.36 57.66 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 115.647 -0.706 . . . . 74.12 110.83 -175.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.7 mmt180 65.52 19.01 11.46 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.173 1.389 . . . . 73.14 113.331 170.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 50.9 mtp -70.64 143.05 89.37 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.708 0.803 . . . . 71.53 112.01 -173.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo . . . . . 0 C--N 1.37 1.676 0 C-N-CA 122.464 2.109 . . . . 74.52 113.194 179.558 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.8 m0 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 113.307 0.854 . . . . 73.23 113.307 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.91 -41.35 19.01 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.149 0.5 . . . . 45.52 110.69 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -80.78 -23.76 39.08 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.134 0.79 . . . . 61.14 113.134 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.43 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 76.8 mt-10 -62.29 -53.69 51.47 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.477 0.486 . . . . 73.5 109.732 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.97 -61.82 1.86 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.95 1.406 . . . . 75.32 111.563 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.54 -41.04 93.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 123.529 0.518 . . . . 54.13 112.304 -179.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 34.1 tt0 -67.87 -63.29 1.09 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 118.035 0.379 . . . . 61.32 111.746 -175.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 2.6 p30 -73.4 -30.58 63.36 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.276 -0.392 . . . . 72.21 111.623 -171.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.55 -23.06 50.18 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-O 119.117 -0.468 . . . . 55.4 111.453 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -60.51 -51.95 67.27 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.588 -0.893 . . . . 64.0 108.588 164.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 36.9 mt-10 -59.44 -40.47 86.9 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 124.085 0.865 . . . . 53.04 111.528 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 14.2 t0 -79.75 -45.97 17.87 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.16 0.984 . . . . 72.01 110.962 -168.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.537 ' HG2' ' HG ' ' A' ' 89' ' ' LEU . 4.3 tmt_? -62.73 -42.98 99.93 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.191 0.997 . . . . 55.51 109.158 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -67.45 -34.24 76.79 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.626 -0.716 . . . . 74.51 111.027 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.25 -24.9 54.55 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.525 0.33 . . . . 53.22 111.847 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.06 -36.75 35.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.845 0.458 . . . . 64.25 110.043 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -80.51 -41.18 24.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.092 0.557 . . . . 73.22 112.042 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.4 tpt -102.54 55.97 0.78 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 107.076 -1.453 . . . . 65.13 107.076 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.422 HD21 ' HE2' ' A' ' 23' ' ' TYR . 42.3 tp . . . . . 0 N--CA 1.469 0.513 0 CA-C-N 114.052 -1.431 . . . . 71.51 111.156 -168.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 110.238 -0.282 . . . . 74.34 110.238 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -59.09 -51.51 69.73 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.789 -0.449 . . . . 73.03 109.789 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.61 -36.7 81.49 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 124.063 0.852 . . . . 65.52 111.375 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -57.53 -47.63 81.48 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 123.532 0.52 . . . . 71.34 109.784 176.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.98 -47.99 78.21 Favored 'General case' 0 C--O 1.212 -0.915 0 O-C-N 123.886 0.741 . . . . 74.31 110.977 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.13 -49.37 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 123.999 0.92 . . . . 73.33 111.313 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.3 mm -71.31 -43.81 73.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 CA-C-N 115.141 -0.936 . . . . 70.32 111.049 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -62.49 -51.19 68.43 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 122.874 0.469 . . . . 70.14 109.987 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -54.33 -46.48 72.89 Favored 'General case' 0 C--O 1.208 -1.116 0 O-C-N 124.453 1.095 . . . . 75.33 110.548 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.44 -52.95 49.77 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 124.332 1.02 . . . . 64.23 113.828 -177.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.41 ' HG3' HD12 ' A' ' 39' ' ' ILE . 27.3 mt-30 -66.25 -40.72 90.4 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 122.842 0.457 . . . . 65.22 111.2 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.44 -37.75 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.885 0.874 . . . . 73.11 110.427 174.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.516 HD11 ' O ' ' A' ' 69' ' ' LEU . 17.0 mt -59.24 -50.8 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.663 1.185 . . . . 71.53 109.804 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -56.97 -43.86 82.04 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.354 1.034 . . . . 75.2 111.286 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.69 -49.41 71.01 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.033 0.533 . . . . 73.04 112.141 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.536 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 10.4 ptm180 -81.8 -16.44 50.92 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.495 0.554 . . . . 64.11 112.495 -174.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 38.5 t -69.03 -19.84 64.12 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.515 0.726 . . . . 75.15 110.775 173.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.13 1.93 6.66 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.48 0.712 . . . . 74.34 112.154 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -65.95 -32.1 73.39 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.246 0.618 . . . . 61.52 111.064 165.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.46 ' SD ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -71.4 86.04 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.824 0.449 . . . . 63.52 110.897 -176.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -71.31 -47.4 56.93 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 106.7 -1.593 . . . . 72.33 106.7 170.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.438 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.8 m-85 -91.53 142.98 27.06 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.358 -1.349 . . . . 71.41 107.358 164.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.531 ' SG ' HG21 ' A' ' 85' ' ' ILE . 38.9 m 63.34 46.05 4.63 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 124.248 0.967 . . . . 75.01 110.247 -160.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 28' ' ' CYS . 56.9 pttt -70.07 -44.29 69.42 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.78 -1.555 . . . . 74.3 111.511 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.721 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 45.1 mtpt -74.22 -26.87 60.5 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 119.178 -0.439 . . . . 74.23 109.83 -178.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -31.22 71.83 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.649 0.593 . . . . 71.44 109.969 171.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.652 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 9.0 t -67.18 -43.63 81.72 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.638 0.775 . . . . 62.44 111.432 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -76.39 -24.84 54.09 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-O 119.84 -0.124 . . . . 73.53 111.027 176.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 4.1 tpm_? -65.09 -59.08 4.52 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.547 -0.909 . . . . 74.34 108.547 176.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 ' SG ' ' A' ' 18' ' ' CYS . 58.3 tp -61.5 -47.42 85.72 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 124.731 1.27 . . . . 51.21 110.615 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.59 -54.74 34.59 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 124.076 0.86 . . . . 54.12 113.67 -174.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -67.01 -32.51 73.79 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.323 0.649 . . . . 73.25 110.617 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 30' ' ' ARG . 1.7 mtt-85 -56.3 -56.93 14.97 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 123.858 0.724 . . . . 73.32 110.645 173.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 31' ' ' LEU . 65.2 t -60.97 -43.22 95.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 CA-C-N 114.156 -1.384 . . . . 74.2 110.559 -175.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.47 -50.42 74.01 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.865 0.466 . . . . 55.23 110.939 177.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.34 -18.63 69.71 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 115.379 -0.828 . . . . 73.44 113.557 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.9 -52.56 5.92 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.771 0.828 . . . . 74.15 110.259 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.41 HD12 ' HG3' ' A' ' 12' ' ' GLN . 16.2 pt -75.89 -32.84 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 118.761 -0.638 . . . . 74.2 111.977 -167.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 44' ' ' MET . 92.7 mttt -58.15 -49.56 92.91 Favored Pre-proline 0 CA--C 1.561 1.401 0 CA-C-O 117.609 -1.186 . . . . 72.14 112.506 -178.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -45.65 -43.37 18.53 Favored 'Trans proline' 0 C--N 1.401 3.306 0 C-N-CA 122.932 2.421 . . . . 72.4 113.485 169.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -71.05 -38.72 72.53 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.653 0.381 . . . . 52.3 111.19 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 47.7 mt-10 -67.42 -20.89 65.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.794 0.438 . . . . 75.13 111.085 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 28.3 mmt -68.55 -55.8 10.46 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 110.008 -0.367 . . . . 70.44 110.008 173.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.682 HD23 ' SD ' ' A' ' 122' ' ' MET . 2.6 pp -70.25 -21.49 62.98 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 111.623 0.231 . . . . 64.4 111.623 179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.3 tm0? -80.44 -33.33 36.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.014 0.926 . . . . 44.52 110.35 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 109.597 -0.52 . . . . 72.01 109.597 178.212 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.4 p . . . . . 0 N--CA 1.477 0.886 0 CA-C-O 119.039 -0.505 . . . . 60.11 109.833 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -52.8 -46.53 67.69 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.439 0.696 . . . . 74.01 112.549 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -64.07 -39.49 94.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.737 0.815 . . . . 61.21 111.568 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 41.1 tp -73.97 -35.55 64.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.11 0.964 . . . . 74.22 110.423 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 m -66.54 -49.69 65.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.942 0.897 . . . . 54.14 109.077 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.436 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 32.3 m -61.04 -38.31 85.69 Favored 'General case' 0 C--N 1.356 0.862 0 O-C-N 124.06 0.85 . . . . 73.01 110.482 178.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.485 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.4 -45.65 83.15 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 123.565 0.746 . . . . 72.33 110.611 -179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.3 mmt -70.17 -24.96 63.23 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 123.821 0.701 . . . . 73.11 111.666 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -71.79 -46.23 58.98 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.218 0.607 . . . . 73.3 110.173 174.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.3 mtt180 -62.44 -38.25 89.02 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.753 0.821 . . . . 73.11 110.311 175.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.1 t80 -63.32 -59.71 4.35 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 113.704 -1.589 . . . . 74.42 109.192 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 25.2 ttpp -56.17 -44.12 79.04 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 124.561 1.163 . . . . 62.34 110.697 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.28 82.65 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 124.258 0.974 . . . . 62.32 112.142 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -68.86 -39.19 79.99 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.511 0.725 . . . . 52.31 111.418 178.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.516 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -68.53 -31.18 70.24 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.713 0.805 . . . . 73.41 111.131 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 55.3 mt-10 -67.44 -43.42 81.19 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.646 -0.501 . . . . 61.51 109.646 174.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.72 -38.97 92.81 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.127 -0.942 . . . . 75.25 111.06 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.13 -44.96 86.97 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.413 0.685 . . . . 52.03 110.578 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -59.8 -41.6 91.56 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 124.328 1.017 . . . . 63.01 110.658 176.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.87 -37.09 91.99 Favored Glycine 0 C--N 1.35 1.307 0 CA-C-N 115.438 -0.801 . . . . 73.1 113.107 177.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.58 -52.2 62.04 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 122.832 0.453 . . . . 75.4 110.458 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.445 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -70.61 -20.0 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 N-CA-C 112.616 0.598 . . . . 74.54 112.616 178.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.536 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 3.3 tm-20 -67.32 -43.37 81.8 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.344 -0.613 . . . . 74.35 109.344 170.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -69.38 -40.87 77.17 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.973 0.909 . . . . 73.43 111.416 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 13.9 m-85 -80.8 0.34 35.28 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.078 0.951 . . . . 74.41 112.511 -173.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -56.43 -32.29 64.76 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.368 0.604 . . . . 71.12 109.859 174.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -82.62 112.23 19.31 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 114.858 -1.065 . . . . 70.11 109.441 168.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -74.9 -24.35 58.52 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.775 0.83 . . . . 73.03 110.566 -177.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -67.48 -37.55 83.05 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.078 0.951 . . . . 63.23 111.076 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.55 -46.22 89.51 Favored 'General case' 0 C--O 1.255 1.37 0 C-N-CA 124.098 0.959 . . . . 71.0 110.076 173.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 97' ' ' LEU . 34.2 mt -58.31 -56.29 17.08 Favored 'Isoleucine or valine' 0 C--N 1.358 0.942 0 CA-C-N 114.573 -1.194 . . . . 61.34 109.956 177.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.3 t -53.91 -39.92 66.24 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.675 1.19 . . . . 33.43 111.612 -176.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -61.04 -54.1 48.94 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 124.544 1.153 . . . . 75.05 111.026 179.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -22.86 53.42 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 116.306 -0.407 . . . . 71.42 111.051 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.1 tp -80.75 -33.77 34.82 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.099 0.96 . . . . 65.13 110.888 -172.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.7 t -72.75 -20.22 61.23 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 121.125 0.488 . . . . 54.11 109.992 172.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.34 8.9 43.67 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.48 1.112 . . . . 43.34 111.244 174.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 67.6 m . . . . . 0 N--CA 1.484 1.269 0 C-N-CA 124.612 1.165 . . . . 61.4 109.466 -178.959 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 9.1 mm . . . . . 0 CA--C 1.547 0.828 0 N-CA-C 108.217 -1.031 . . . . 75.32 108.217 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.644 HD11 HG23 ' A' ' 85' ' ' ILE . 4.5 tp -58.13 -30.51 66.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.928 0.714 . . . . 72.04 112.928 -168.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -119.63 17.88 12.76 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-O 118.159 -0.924 . . . . 70.2 110.645 -176.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -36.3 -53.32 0.83 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 115.024 1.491 . . . . 73.5 115.024 -160.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . 0.46 ' N ' ' HD3' ' A' ' 99' ' ' LYS . 30.6 m-20 -71.3 -50.75 29.34 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 118.648 0.658 . . . . 73.14 111.564 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.92 -52.82 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 123.944 0.898 . . . . 54.21 111.18 -176.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -63.78 -36.88 85.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.334 1.054 . . . . 75.34 110.998 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -62.71 -32.26 73.33 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.197 0.599 . . . . 64.14 110.717 172.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 98.9 mttt -70.99 -39.74 72.27 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 119.348 -0.358 . . . . 55.41 110.214 174.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.2 -44.61 88.18 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.603 -0.517 . . . . 73.54 109.603 172.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.4 m -63.11 -50.42 70.57 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.015 0.926 . . . . 60.53 111.347 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 37.6 t70 -73.56 -44.05 58.35 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 115.128 -0.942 . . . . 74.44 111.184 -171.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 93.8 t -64.06 -36.48 77.0 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 118.843 -0.598 . . . . 72.42 109.416 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -64.21 -44.71 91.08 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 119.088 -0.482 . . . . 74.14 112.055 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 8.5 ptmm? -64.78 -44.31 90.42 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 118.568 0.622 . . . . 51.12 110.378 177.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 11.9 mm-40 -60.8 -41.04 94.86 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.044 0.449 . . . . 61.11 111.076 176.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.6 tp -61.57 -59.96 4.42 Favored 'General case' 0 C--O 1.215 -0.726 0 C-N-CA 124.633 1.173 . . . . 72.33 107.941 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 33.0 t -55.82 -41.22 73.88 Favored 'General case' 0 C--N 1.35 0.601 0 O-C-N 124.557 1.16 . . . . 70.52 111.402 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 81.0 mt -57.7 -54.88 41.87 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.886 0.741 . . . . 71.33 111.481 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.21 -23.74 63.93 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 122.497 -0.127 . . . . 63.14 111.185 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.614 HD13 ' SD ' ' A' ' 122' ' ' MET . 95.8 mt -73.86 -28.38 61.55 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.769 0.828 . . . . 74.42 111.038 174.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 113' ' ' SER . 27.6 mm-40 -71.94 -43.67 64.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.025 0.53 . . . . 74.42 109.639 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.84 -50.07 26.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 116.036 -0.529 . . . . 64.32 112.046 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . 0.417 ' HB2' ' OE1' ' A' ' 120' ' ' GLN . 8.6 mm-40 -82.61 -57.61 3.26 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 111.936 0.347 . . . . 75.3 111.936 -171.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.417 ' OE1' ' HB2' ' A' ' 119' ' ' GLU . 24.5 mp0 -89.14 -29.85 19.04 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.519 0.328 . . . . 73.23 111.559 -176.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 56.39 61.84 2.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.465 1.106 . . . . 71.12 110.92 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.682 ' SD ' HD23 ' A' ' 45' ' ' LEU . 22.4 ptm -91.32 147.17 34.88 Favored Pre-proline 0 N--CA 1.476 0.843 0 CA-C-N 114.569 -1.196 . . . . 73.31 108.109 172.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo . . . . . 0 C--N 1.374 1.88 0 C-N-CA 122.225 1.95 . . . . 71.15 113.264 -174.73 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 27.4 m0 . . . . . 0 N--CA 1.473 0.723 0 N-CA-C 113.141 0.793 . . . . 71.22 113.141 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.43 -27.89 40.17 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.056 0.762 . . . . 20.4 113.056 -174.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -88.13 -43.25 11.8 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.121 0.569 . . . . 73.14 110.638 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.405 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 45.3 mt-10 -59.59 -34.69 73.06 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.2 1.0 . . . . 73.3 112.778 -177.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 55.8 m-20 -61.25 -64.39 0.97 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.338 0.655 . . . . 73.21 109.885 -176.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -61.45 -43.98 97.91 Favored 'General case' 0 C--O 1.213 -0.824 0 O-C-N 124.059 0.849 . . . . 64.45 110.864 -178.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.9 tm0? -64.88 -60.22 3.32 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.399 0.68 . . . . 61.43 110.878 -171.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -67.46 -43.91 79.92 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-N 114.906 -1.043 . . . . 71.23 111.023 -173.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.88 -32.35 72.78 Favored 'General case' 0 C--N 1.358 0.955 0 CA-C-N 116.103 -0.499 . . . . 43.53 111.945 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 31.2 t70 -65.8 -47.63 74.45 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.541 0.526 . . . . 71.14 110.569 176.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -58.51 -41.41 85.34 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 124.108 0.88 . . . . 50.42 111.18 177.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.4 t0 -64.96 -42.81 94.26 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.762 0.825 . . . . 63.54 111.724 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -62.36 -37.56 86.15 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.331 -0.849 . . . . 61.25 109.743 175.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 97.9 mtt180 -62.63 -43.07 99.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.837 0.455 . . . . 74.11 109.926 174.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.61 -22.13 62.57 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.018 0.824 . . . . 44.2 111.91 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.2 OUTLIER -81.72 -55.64 4.51 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 122.981 0.512 . . . . 75.54 110.022 176.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -69.32 -61.38 1.81 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.524 -0.762 . . . . 75.23 110.026 -175.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.3 ttm -86.06 72.14 10.47 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.269 -1.382 . . . . 74.5 107.269 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp . . . . . 0 CA--C 1.539 0.528 0 CA-C-N 115.373 -0.831 . . . . 64.3 109.668 -178.148 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 113.836 1.05 . . . . 74.0 113.836 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -61.33 -40.0 92.6 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.821 0.448 . . . . 63.44 112.08 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -68.8 -38.18 79.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.284 0.564 . . . . 72.11 109.66 -177.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -68.61 -34.48 75.85 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.081 0.952 . . . . 73.45 108.932 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -66.31 -37.94 86.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.93 0.492 . . . . 74.3 110.426 177.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 85.9 mt -57.21 -50.59 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.781 0.832 . . . . 64.13 110.52 171.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.617 HG23 ' HG2' ' A' ' 43' ' ' GLU . 19.5 mm -63.25 -42.85 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 115.668 -0.696 . . . . 72.04 111.305 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -63.53 -51.79 63.97 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 123.848 0.859 . . . . 63.01 110.471 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.434 HD11 ' HE2' ' A' ' 66' ' ' LYS . 82.4 mt -59.22 -53.0 63.28 Favored 'General case' 0 C--O 1.216 -0.699 0 O-C-N 124.04 0.838 . . . . 73.1 110.49 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.456 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -57.53 -38.62 88.26 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 124.64 1.212 . . . . 73.23 113.9 -177.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -74.4 -43.68 55.3 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 122.536 -0.39 . . . . 53.23 110.666 -179.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.84 -24.32 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.546 0.339 . . . . 64.14 110.353 175.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 35' ' ' VAL . 51.3 mt -64.43 -52.9 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.729 0.812 . . . . 62.02 108.913 171.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -54.34 -36.8 64.19 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 124.234 0.959 . . . . 73.42 111.25 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -72.04 -66.0 0.7 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.828 0.851 . . . . 75.14 111.34 178.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HD2' HG13 ' A' ' 76' ' ' ILE . 9.7 ptp180 -68.34 -19.31 64.64 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.732 0.813 . . . . 44.13 112.564 -170.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.9 t -64.59 -29.85 70.87 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.751 0.42 . . . . 71.53 110.874 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.44 -6.43 24.74 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.522 0.564 . . . . 71.24 112.522 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.81 -28.43 69.86 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 119.424 -0.322 . . . . 74.51 110.797 169.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . 0.512 ' SD ' HD11 ' A' ' 85' ' ' ILE . 3.2 mmt -65.66 94.57 0.2 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.982 -0.748 . . . . 71.34 108.982 176.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -72.88 -26.69 61.53 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.816 0.817 . . . . 65.24 110.123 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' HD22 ' A' ' 151' ' ' LEU . 92.7 m-85 -93.88 -174.25 3.38 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.413 -1.721 . . . . 70.32 109.265 166.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.482 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 56.8 m 54.32 53.9 10.24 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.814 0.845 . . . . 71.21 112.8 174.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.0 -52.45 65.48 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.963 0.905 . . . . 73.33 112.14 -175.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 19.3 tptm -68.19 -47.83 66.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.279 -0.873 . . . . 75.15 110.993 -173.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 30' ' ' ARG . 19.1 mt-30 -73.02 -25.48 60.97 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.788 0.662 . . . . 75.0 112.788 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 t -71.19 -49.44 43.67 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.99 0.516 . . . . 65.53 110.271 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -73.35 -22.0 60.4 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.425 -0.807 . . . . 74.42 111.053 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.826 HH12 ' HB2' ' A' ' 98' ' ' PHE . 19.1 ttt-85 -63.12 -52.93 60.6 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.314 1.046 . . . . 75.54 110.043 169.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.87 -49.42 77.82 Favored 'General case' 0 C--N 1.359 1.011 0 O-C-N 123.843 0.714 . . . . 63.23 109.705 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.14 96.6 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 124.301 1.001 . . . . 51.32 112.895 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -63.12 -49.12 75.68 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.879 0.872 . . . . 72.0 111.019 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.487 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 84.1 mtt-85 -61.56 -56.37 20.72 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.053 0.846 . . . . 72.33 110.716 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.503 HG21 HG21 ' A' ' 14' ' ' ILE . 58.6 t -56.23 -46.44 81.38 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 O-C-N 124.296 0.997 . . . . 73.31 111.407 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 39' ' ' ILE . 72.3 mt -62.77 -40.98 98.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 123.443 0.465 . . . . 73.33 111.25 177.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.29 -27.56 71.78 Favored Glycine 0 CA--C 1.532 1.114 0 O-C-N 123.379 0.425 . . . . 75.42 112.951 177.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.586 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 47.9 mt -84.52 -47.75 10.28 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.305 0.642 . . . . 64.54 111.481 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 36' ' ' LEU . 22.4 pt -76.83 -40.28 31.64 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.357 0 CA-C-O 117.807 -1.092 . . . . 73.53 111.409 -171.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -54.39 -47.79 96.61 Favored Pre-proline 0 N--CA 1.493 1.675 0 N-CA-C 113.553 0.946 . . . . 75.15 113.553 -169.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.38 -48.01 23.81 Favored 'Trans proline' 0 C--N 1.401 3.315 0 C-N-CA 122.003 1.802 . . . . 53.54 111.395 171.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 4' ' ' LEU . 4.3 mm? -69.89 -25.23 63.6 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 124.087 0.867 . . . . 63.13 111.474 -177.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.617 ' HG2' HG23 ' A' ' 8' ' ' ILE . 43.4 mt-10 -67.22 -52.08 45.49 Favored 'General case' 0 C--N 1.354 0.783 0 N-CA-C 108.544 -0.91 . . . . 62.21 108.544 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 70.6 mtm -57.63 -45.85 84.9 Favored 'General case' 0 C--N 1.351 0.668 0 O-C-N 124.211 0.944 . . . . 54.44 110.306 177.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.9 mt -71.62 -21.57 61.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.732 0.813 . . . . 65.31 112.607 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.65 -53.11 7.95 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.581 0.753 . . . . 63.42 109.807 178.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 . . . . . 0 N--CA 1.482 1.17 0 O-C-N 123.681 0.613 . . . . 52.24 111.361 -179.091 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.543 0.697 0 N-CA-C 109.91 -0.404 . . . . 42.31 109.91 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -59.94 -50.7 72.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.967 0.507 . . . . 75.34 110.741 -175.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.84 67.13 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.637 -0.71 . . . . 53.32 112.051 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 33.4 tp -66.72 -48.89 67.77 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.903 0.481 . . . . 71.1 110.047 177.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.8 m -60.52 -43.36 97.18 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 124.189 0.931 . . . . 74.41 110.136 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -56.46 -47.65 78.71 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 123.793 0.683 . . . . 53.13 110.959 176.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.44 98.77 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.373 0.669 . . . . 72.44 111.439 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.47 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.1 mmt -64.71 -34.09 77.49 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.292 0.637 . . . . 75.43 111.266 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -73.72 -35.29 65.09 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.218 0.607 . . . . 70.41 110.653 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -66.06 -39.58 90.21 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.688 0.795 . . . . 65.4 110.27 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.586 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 3.3 t80 -70.76 -42.45 70.43 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.188 0.995 . . . . 73.21 110.234 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.434 ' HE2' HD11 ' A' ' 10' ' ' LEU . 14.7 tmtt? -64.72 -38.92 92.63 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.48 1.112 . . . . 75.2 110.053 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.8 -40.6 92.05 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.381 0.673 . . . . 72.02 111.009 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.67 80.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.385 0.674 . . . . 73.23 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -72.09 -26.09 62.01 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.786 -0.643 . . . . 75.1 111.067 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.72 -34.37 71.84 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.906 0.482 . . . . 72.14 110.351 172.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.505 ' HB3' HG22 ' A' ' 101' ' ' VAL . 25.3 mm-40 -64.13 -44.46 92.14 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.985 -0.552 . . . . 65.12 110.878 175.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -63.29 -59.72 4.34 Favored 'General case' 0 C--N 1.354 0.796 0 O-C-N 123.454 0.471 . . . . 53.13 110.555 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -47.64 -46.35 28.8 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.019 1.728 . . . . 73.43 111.875 -176.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.2 -44.05 87.59 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.471 1.107 . . . . 60.34 113.416 -176.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.479 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . 25.4 mt-10 -67.06 -48.36 68.49 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 118.294 -0.86 . . . . 72.43 111.028 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.605 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.8 pt -66.37 -26.77 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 CA-C-N 118.704 0.684 . . . . 73.14 111.678 176.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -60.77 -40.96 94.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.11 0.564 . . . . 72.04 110.232 171.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -85.39 -22.65 28.29 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.874 0.694 . . . . 74.24 112.874 175.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.605 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.2 m-85 -79.33 -1.63 37.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.549 0.74 . . . . 71.35 111.68 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.4 p -56.74 -26.33 56.91 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.424 0.689 . . . . 63.51 110.775 172.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -82.73 112.4 19.55 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 107.548 -1.278 . . . . 75.32 107.548 162.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.496 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.7 mpt_? -70.78 -23.69 62.44 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.069 0.548 . . . . 62.02 110.821 -175.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 25.5 m -63.73 -33.97 76.85 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.158 0.983 . . . . 61.01 111.66 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -57.09 -45.82 83.04 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.157 0.983 . . . . 51.43 110.075 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' A' ' 21' ' ' MET . 21.1 mt -60.79 -54.82 29.99 Favored 'Isoleucine or valine' 0 C--N 1.352 0.694 0 O-C-N 124.248 0.967 . . . . 75.34 109.869 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 27.5 t -57.18 -38.03 73.01 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.585 0.553 . . . . 74.31 111.678 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -63.18 -47.93 80.53 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 124.184 0.927 . . . . 74.53 111.243 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.95 -29.88 50.09 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 110.096 -0.335 . . . . 71.32 110.096 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 11.7 tp -69.04 -39.05 79.42 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.934 0.894 . . . . 71.03 110.254 -172.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -78.01 -27.59 48.97 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.346 0.659 . . . . 43.33 110.84 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.72 -55.39 4.86 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.519 0.728 . . . . 52.3 111.189 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.2 t . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 108.834 -0.802 . . . . 53.15 108.834 175.1 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.475 HG23 ' HB2' ' A' ' 141' ' ' ALA . 3.3 mm . . . . . 0 CA--C 1.549 0.909 0 N-CA-C 106.531 -1.655 . . . . 75.43 106.531 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -39.9 -48.25 2.29 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.158 0.983 . . . . 71.53 111.925 -173.008 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.826 ' HB2' HH12 ' A' ' 30' ' ' ARG . 72.7 m-85 -128.42 47.44 2.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.06 0.944 . . . . 70.45 111.256 176.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.1 -62.13 1.85 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 124.418 1.087 . . . . 71.32 111.571 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.07 -42.55 96.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.174 -1.375 . . . . 71.15 110.76 -175.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 71' ' ' GLU . 61.3 t -63.21 -41.72 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 114.829 -1.078 . . . . 74.22 111.498 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -71.65 -32.94 68.47 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.351 0.66 . . . . 71.5 110.578 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -63.4 -41.38 98.75 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 108.904 -0.776 . . . . 73.13 108.904 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 60.3 mttm -63.37 -49.1 75.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.575 -0.739 . . . . 60.51 110.683 174.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.81 -42.21 97.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.938 0.895 . . . . 74.42 111.22 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.462 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 37.4 t -71.12 -47.79 55.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.054 0.846 . . . . 52.12 110.198 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.569 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 27.3 t70 -57.82 -57.2 13.81 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 124.051 0.844 . . . . 64.43 110.381 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.1 -38.59 82.85 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 CA-C-N 114.945 -1.025 . . . . 63.21 111.272 -178.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -60.46 -42.06 95.42 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.189 0.45 . . . . 74.11 111.221 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.569 ' HE2' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtmt -58.91 -57.0 15.01 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 109.665 -0.494 . . . . 73.52 109.665 174.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.66 -44.56 69.76 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.569 0.748 . . . . 74.45 111.784 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.47 HD11 ' SD ' ' A' ' 62' ' ' MET . 9.1 tt -70.21 -55.94 8.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.292 1.437 . . . . 53.32 109.885 -172.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.0 t -61.87 -31.64 71.92 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.836 0.855 . . . . 74.04 111.326 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 51.5 mt -70.24 -51.16 32.83 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 122.963 0.505 . . . . 71.23 111.031 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.87 -24.3 65.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.047 0.385 . . . . 74.43 110.497 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.651 HD22 ' SD ' ' A' ' 122' ' ' MET . 42.2 mt -64.53 -55.51 20.13 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 119.239 -0.41 . . . . 52.53 110.415 172.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -68.77 -32.8 72.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.438 0.533 . . . . 74.02 112.438 -174.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.9 -60.92 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.131 0.572 . . . . 73.11 110.802 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -84.21 -55.93 3.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.251 0.62 . . . . 72.31 111.748 -169.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.511 HE21 ' HA ' ' A' ' 116' ' ' LEU . 2.4 mp0 -82.86 -5.36 58.95 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 122.575 0.35 . . . . 70.43 111.723 -178.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 62.74 25.33 15.05 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.803 1.241 . . . . 73.41 112.344 172.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 116' ' ' LEU . 69.4 mtp -84.81 126.31 68.66 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.239 1.016 . . . . 63.03 109.998 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo . . . . . 0 C--N 1.374 1.915 0 C-N-CA 123.086 2.524 . . . . 61.12 113.44 -172.747 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 112.381 0.511 . . . . 73.22 112.381 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.3 67.39 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.927 0.491 . . . . 45.24 110.669 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -69.27 -31.22 69.6 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.829 -0.623 . . . . 75.21 111.046 -177.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -55.72 -58.56 7.31 Favored 'General case' 0 C--O 1.211 -0.974 0 O-C-N 124.062 0.851 . . . . 62.44 110.407 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.63 -42.51 75.06 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.926 1.084 . . . . 75.4 113.926 -173.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.104 0.253 . . . . 75.44 110.857 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . 0.474 HE21 ' HG3' ' A' ' 143' ' ' GLU . 22.6 tp60 -70.96 -35.43 72.16 Favored 'General case' 0 C--N 1.359 1.0 0 O-C-N 123.099 0.249 . . . . 74.54 110.928 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -64.63 -56.42 13.94 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.986 -0.746 . . . . 40.13 108.986 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.475 ' HB2' HG23 ' A' ' 96' ' ' ILE . . . -58.11 -36.8 73.42 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 124.399 1.062 . . . . 34.34 111.95 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -56.93 -64.09 0.99 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 122.868 0.467 . . . . 64.34 110.155 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . 0.474 ' HG3' HE21 ' A' ' 139' ' ' GLN . 45.5 mt-10 -63.69 -38.41 91.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.979 0.912 . . . . 75.43 111.922 -174.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 18.2 t0 -86.01 -45.19 11.68 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.385 -0.825 . . . . 73.51 111.942 -165.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . 0.432 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 54.4 ttt-85 -65.45 -36.68 84.64 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.406 -0.59 . . . . 64.23 109.406 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 38.5 ttt180 -63.58 -44.45 94.02 Favored 'General case' 0 C--N 1.356 0.887 0 CA-C-N 116.013 -0.539 . . . . 72.22 110.514 173.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.36 -19.53 61.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.261 0.624 . . . . 63.33 112.576 -179.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.482 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.7 OUTLIER -78.21 -60.47 2.36 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 109.138 -0.69 . . . . 63.23 109.138 176.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -70.39 -26.01 63.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.06 -0.973 . . . . 73.23 110.891 -173.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 41.9 ttp -117.31 56.85 0.81 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 107.388 -1.338 . . . . 73.13 107.388 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.406 HD22 ' CE1' ' A' ' 23' ' ' TYR . 59.9 tp . . . . . 0 C--N 1.351 0.673 0 CA-C-N 115.512 -0.767 . . . . 70.41 109.452 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.339 -0.245 . . . . 74.04 110.339 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -57.3 -51.16 70.51 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 109.432 -0.581 . . . . 73.32 109.432 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.37 -39.82 73.55 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.785 0.834 . . . . 61.43 111.247 178.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.52 -51.32 69.1 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.462 -0.94 . . . . 62.22 108.462 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -59.37 -52.75 64.27 Favored 'General case' 0 C--O 1.215 -0.725 0 O-C-N 123.788 0.68 . . . . 70.31 110.71 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.451 HG22 HD12 ' A' ' 8' ' ' ILE . 97.7 mt -52.92 -55.01 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.397 1.479 . . . . 62.0 112.365 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.451 HD12 HG22 ' A' ' 7' ' ' ILE . 1.7 mp -67.67 -36.88 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 124.046 0.938 . . . . 72.02 110.959 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.6 m -65.75 -46.03 80.36 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.343 0.657 . . . . 62.43 110.411 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.79 -44.44 86.27 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 123.72 0.808 . . . . 61.22 109.736 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.463 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -60.29 -53.4 45.94 Favored Glycine 0 C--N 1.347 1.164 0 O-C-N 124.251 0.969 . . . . 73.03 113.052 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.466 ' HG3' HD12 ' A' ' 39' ' ' ILE . 33.5 mt-30 -66.41 -31.95 73.03 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 112.033 0.383 . . . . 74.1 112.033 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -70.36 -36.92 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.331 0.653 . . . . 70.32 110.723 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.413 HG21 HG21 ' A' ' 35' ' ' VAL . 37.3 mt -58.77 -49.24 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.641 0.776 . . . . 72.24 109.056 175.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -56.47 -52.9 62.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.695 -1.139 . . . . 71.53 111.343 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -60.7 -57.61 11.95 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 123.799 0.687 . . . . 73.11 111.053 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -73.58 -17.19 61.21 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 112.683 0.623 . . . . 75.12 112.683 -173.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 45.7 t -60.41 -17.11 41.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.147 0.579 . . . . 71.21 111.578 170.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -55.13 -23.38 20.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.514 0.726 . . . . 74.45 112.175 172.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -66.02 -15.6 63.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.456 0.702 . . . . 64.13 112.036 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.0 mmt -78.14 82.69 4.46 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.858 -0.793 . . . . 71.41 108.858 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -35.45 73.9 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.781 -1.192 . . . . 65.42 107.781 173.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.423 ' HE2' HD22 ' A' ' 151' ' ' LEU . 70.7 m-85 -97.03 177.16 5.7 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.656 -1.156 . . . . 61.42 109.569 165.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 70.9 m 54.53 58.11 5.18 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.772 0.796 . . . . 74.15 109.835 -173.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -70.1 -49.83 46.9 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-N 114.255 -1.339 . . . . 75.4 110.872 -169.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 24.0 mmtp -61.1 -46.61 89.91 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 108.495 -0.928 . . . . 73.3 108.495 177.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -57.66 -36.09 71.43 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.343 1.027 . . . . 72.22 113.441 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 40.7 t -70.9 -42.32 70.1 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.405 0.44 . . . . 74.23 110.667 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -71.71 -28.3 63.6 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 115.71 -0.677 . . . . 73.32 110.945 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.698 ' HD2' ' HB3' ' A' ' 136' ' ' GLU . 33.7 ttp180 -82.6 -38.05 24.15 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.489 1.116 . . . . 73.44 109.788 -173.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.2 tp -65.75 -43.39 89.08 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.178 -1.045 . . . . 74.24 108.178 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.93 -35.36 90.37 Favored Glycine 0 C--N 1.351 1.398 0 O-C-N 123.753 0.658 . . . . 34.23 112.745 173.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -64.78 -51.52 61.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.344 0.658 . . . . 74.53 110.742 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.1 mtt-85 -57.6 -59.49 5.11 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.609 -1.178 . . . . 74.11 110.155 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.413 HG21 HG21 ' A' ' 14' ' ' ILE . 54.6 t -58.86 -52.38 61.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 124.668 1.23 . . . . 73.35 112.05 -174.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.28 -45.87 82.69 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 118.046 0.384 . . . . 63.34 110.349 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.41 -24.49 65.79 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 123.258 0.349 . . . . 53.11 113.494 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.458 ' O ' HD23 ' A' ' 42' ' ' LEU . 11.4 tp -86.84 -40.15 15.18 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.577 1.151 . . . . 52.44 112.071 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.466 HD12 ' HG3' ' A' ' 12' ' ' GLN . 15.6 pt -84.6 -33.76 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-O 119.275 -0.393 . . . . 74.03 111.792 -171.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -54.3 -53.76 55.6 Favored Pre-proline 0 N--CA 1.49 1.542 0 CA-C-O 117.992 -1.004 . . . . 71.21 113.131 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.773 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 20.8 Cg_endo -57.68 -38.66 92.5 Favored 'Trans proline' 0 C--N 1.396 3.053 0 C-N-CA 122.218 1.945 . . . . 43.22 112.243 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.5 mm? -66.64 -36.34 82.34 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.609 -0.723 . . . . 71.24 111.296 178.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -73.53 -29.42 62.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.913 0.885 . . . . 71.41 111.666 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.7 mmt -64.9 -33.39 75.91 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.828 0.451 . . . . 61.1 111.336 178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.38 -41.5 14.43 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.572 0.349 . . . . 73.33 111.773 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -58.86 -45.82 89.21 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.543 0.737 . . . . 75.42 111.95 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 . . . . . 0 N--CA 1.478 0.967 0 C-N-CA 123.435 0.694 . . . . 72.12 111.167 -171.775 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.2 p . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 110.197 -0.297 . . . . 71.34 110.197 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -54.21 -51.78 63.34 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.634 0.774 . . . . 74.35 110.85 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -55.85 -38.73 70.45 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.932 0.893 . . . . 70.32 112.351 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 62' ' ' MET . 62.0 tp -67.65 -51.89 44.56 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 124.059 0.944 . . . . 73.12 109.275 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.3 m -61.64 -36.69 81.51 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.281 1.032 . . . . 55.53 111.521 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.8 m -66.67 -47.78 71.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.334 0.654 . . . . 71.11 109.382 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 65' ' ' PHE . . . -56.43 -41.29 76.15 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.722 -0.672 . . . . 75.34 110.178 175.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' LEU . 25.1 mmt -67.25 -28.45 68.05 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.987 0.915 . . . . 70.14 111.934 177.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -70.29 -49.08 53.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.84 0.456 . . . . 54.22 110.767 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -68.19 -33.77 75.06 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 120.529 0.204 . . . . 74.41 110.562 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 1.8 t80 -61.1 -56.25 23.03 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.945 1.298 . . . . 75.11 109.674 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 48.8 tttm -55.77 -50.06 71.46 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.224 -1.353 . . . . 74.15 110.695 175.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.47 -49.86 69.08 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.104 0.961 . . . . 63.1 112.15 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.34 -28.85 64.37 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.412 0.685 . . . . 62.33 111.722 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.4 mt -75.64 -28.18 58.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.718 0.407 . . . . 74.32 111.696 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 51.4 mt-10 -69.92 -42.69 72.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 109.445 -0.576 . . . . 63.34 109.445 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 42.4 mt-10 -63.66 -45.38 90.42 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.979 -1.009 . . . . 72.32 110.354 176.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.6 98.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.278 0.631 . . . . 71.34 111.39 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -57.8 -44.8 86.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.763 1.225 . . . . 64.45 110.265 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -68.23 -32.98 77.03 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 114.764 -1.107 . . . . 44.41 113.209 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 48.7 mm-40 -68.0 -51.06 51.53 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 116.915 0.357 . . . . 72.22 110.866 -179.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.557 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -66.44 -28.79 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 118.269 0.486 . . . . 74.42 112.284 175.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -60.74 -41.71 95.93 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.867 -0.79 . . . . 52.05 108.867 172.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -69.25 -39.61 78.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.842 1.257 . . . . 54.31 111.008 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.473 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 18.4 m-85 -81.46 5.45 17.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.996 0.918 . . . . 74.51 112.443 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.9 p -56.7 -32.56 65.59 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.214 0.53 . . . . 65.41 110.199 171.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -86.99 117.56 25.79 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.922 -1.036 . . . . 70.23 109.209 168.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.576 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.4 mpt_? -78.87 -26.17 43.94 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.229 1.012 . . . . 64.13 109.803 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -61.26 -38.65 87.45 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.92 0.888 . . . . 65.14 110.601 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.64 -44.26 96.59 Favored 'General case' 0 C--O 1.257 1.45 0 C-N-CA 124.265 1.026 . . . . 75.42 110.595 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.449 HG12 ' CD1' ' A' ' 79' ' ' PHE . 19.6 mt -60.93 -54.86 29.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 CA-C-N 115.091 -0.958 . . . . 62.42 109.611 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.8 t -54.66 -43.05 72.06 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.556 0.743 . . . . 63.51 111.235 -177.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 49.3 ttm-85 -56.67 -54.98 39.83 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.508 1.13 . . . . 74.12 111.362 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.479 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.18 -26.32 56.07 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.508 -0.314 . . . . 74.21 110.541 -176.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp -71.24 -43.72 66.73 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.077 0.951 . . . . 71.22 110.701 -170.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.6 t -65.08 -19.81 66.17 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.074 -0.966 . . . . 73.14 110.805 177.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.55 -26.97 14.24 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.312 1.045 . . . . 71.44 112.175 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.477 0.921 0 C-N-CA 122.774 0.429 . . . . 62.33 110.255 -172.174 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 12.9 mt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 107.984 -1.117 . . . . 63.22 107.984 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.479 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 7.1 mp -53.26 -39.22 63.69 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.699 1.599 . . . . 73.11 112.2 175.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 81.6 m-85 -122.87 35.07 4.96 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.331 0.653 . . . . 72.11 111.16 -173.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.669 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 38.3 tttm -63.3 -52.42 62.01 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.066 0.848 . . . . 63.43 110.45 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -75.02 -37.63 61.72 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.653 -0.703 . . . . 61.11 110.737 -175.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.69 -39.08 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 122.598 0.359 . . . . 75.34 110.814 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.4 -25.33 50.72 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.082 0.553 . . . . 64.32 110.767 176.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.71 -43.93 97.9 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.63 -0.507 . . . . 64.44 109.63 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -58.68 7.41 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.375 -0.602 . . . . 75.32 109.375 171.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.4 mt -54.42 -32.55 57.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.823 0.849 . . . . 62.24 112.466 -177.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.9 t -78.36 -47.1 18.39 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.631 0.772 . . . . 71.23 111.237 -176.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.652 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 22.5 t70 -69.34 -41.36 76.75 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 121.427 0.632 . . . . 53.22 110.436 -177.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.18 -48.54 86.52 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 CA-C-N 114.792 -1.095 . . . . 74.45 109.706 171.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . 0.602 ' HE3' HD23 ' A' ' 112' ' ' LEU . 10.6 t-105 -63.15 -25.62 68.43 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.333 0.653 . . . . 72.45 112.119 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.6 mtpt -63.66 -63.05 1.28 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.701 -0.851 . . . . 74.24 108.701 171.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.33 -47.23 72.75 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.91 0.862 . . . . 73.31 110.679 -177.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 109' ' ' TRP . 47.5 tp -60.11 -56.25 23.89 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 112.902 -1.954 . . . . 61.12 110.529 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 91.3 p -61.25 -33.86 74.21 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.562 0.345 . . . . 72.52 111.843 -176.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.3 mt -63.33 -54.86 30.32 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 123.814 0.696 . . . . 72.12 110.134 176.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 pp -69.38 -23.7 63.77 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 111.84 0.311 . . . . 75.32 111.84 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.443 HD13 ' SD ' ' A' ' 122' ' ' MET . 85.8 mt -70.78 -45.03 65.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.891 0.476 . . . . 55.23 111.28 174.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -79.29 -31.11 43.23 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 122.111 -0.368 . . . . 75.31 111.6 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 76.3 t -83.47 -48.64 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 C-N-CA 122.7 0.4 . . . . 64.11 110.965 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -90.85 -57.94 2.64 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.272 0.558 . . . . 64.52 111.22 -176.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -83.03 -0.76 50.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.577 -0.738 . . . . 73.42 111.644 -170.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 62.26 24.16 14.35 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.156 1.382 . . . . 63.31 113.44 171.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.773 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 49.1 ttm -78.06 131.66 69.15 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 123.936 0.894 . . . . 72.42 110.396 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 C--N 1.378 2.082 0 C-N-CA 122.127 1.885 . . . . 62.23 111.799 179.126 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.1 m0 . . . . . 0 N--CA 1.482 1.17 0 N-CA-C 113.364 0.876 . . . . 75.01 113.364 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.63 -55.28 16.01 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.155 0.582 . . . . 62.52 110.281 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -29.41 70.61 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.186 -0.915 . . . . 73.02 111.7 -177.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.698 ' HB3' ' HD2' ' A' ' 30' ' ' ARG . 34.9 mt-10 -57.04 -60.46 3.56 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.706 1.202 . . . . 73.42 110.787 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.608 ' HB3' HD13 ' A' ' 96' ' ' ILE . 32.5 m-20 -56.36 -39.8 73.48 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 116.293 -0.412 . . . . 74.22 111.431 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.23 -64.45 0.86 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 123.141 0.276 . . . . 73.52 111.043 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -62.36 -50.54 71.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.571 0.701 . . . . 53.54 110.674 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 3.1 m-20 -75.48 -40.54 57.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.234 -1.348 . . . . 73.44 112.135 -167.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . 0.523 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.36 -22.39 59.24 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 118.923 0.783 . . . . 60.34 111.269 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 35.7 t70 -70.98 -34.5 71.46 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 109.76 -0.459 . . . . 72.52 109.76 169.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -68.62 -35.46 77.34 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.203 0.601 . . . . 63.45 111.199 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.38 -36.45 68.73 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.156 0.582 . . . . 73.35 110.467 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 45.1 ttt180 -58.37 -45.56 88.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.657 -1.156 . . . . 71.53 109.958 171.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 48.5 mtt180 -66.99 -39.9 87.24 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.321 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.439 ' O ' HD13 ' A' ' 151' ' ' LEU . . . -71.16 -23.01 61.98 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.287 0.635 . . . . 72.14 111.617 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . 0.454 ' HB3' HE21 ' A' ' 149' ' ' GLN . 0.1 OUTLIER -86.95 -60.5 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.415 0.626 . . . . 64.3 111.251 175.452 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . 0.454 HE21 ' HB3' ' A' ' 148' ' ' PHE . 33.1 mm-40 -82.69 -27.09 31.48 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.904 -1.044 . . . . 74.33 112.654 -165.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.1 ttm -100.04 -70.88 0.72 Allowed 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.788 -0.819 . . . . 72.25 108.788 173.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 147' ' ' ALA . 16.6 tp . . . . . 0 CA--C 1.558 1.261 0 C-N-CA 125.221 1.409 . . . . 64.03 111.818 -179.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 121.349 0.595 . . . . 64.3 110.109 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -71.02 -29.28 65.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.692 -1.14 . . . . 74.52 110.842 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.473 HD21 HD12 ' A' ' 42' ' ' LEU . 0.9 OUTLIER -73.59 -40.17 64.08 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.162 -0.681 . . . . 74.15 109.162 -179.196 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.447 ' O ' ' HD3' ' A' ' 5' ' ' LYS . 6.8 tmtt? -71.38 -30.98 66.77 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.305 -0.998 . . . . 75.23 108.305 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.498 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 57.5 t-80 -64.61 -40.61 95.8 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 119.304 -0.379 . . . . 65.43 110.14 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 93.6 mt -56.83 -46.14 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 C-N-CA 124.262 1.025 . . . . 74.54 110.526 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.481 HD12 ' HG2' ' A' ' 43' ' ' GLU . 34.1 mm -54.54 -54.15 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 115.16 -0.927 . . . . 51.24 110.547 174.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.2 m -57.52 -40.1 78.03 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 124.409 1.084 . . . . 73.42 111.252 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 93.4 mt -61.18 -57.9 10.53 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 123.923 0.764 . . . . 75.3 109.99 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . 0.612 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.18 -36.04 73.17 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 124.65 1.219 . . . . 74.4 113.583 -176.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -62.8 -54.39 39.69 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.876 0.47 . . . . 63.5 110.904 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.62 -31.19 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.73 0.812 . . . . 61.45 111.269 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.549 HG23 HD11 ' A' ' 76' ' ' ILE . 36.5 mt -61.96 -60.12 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.612 1.165 . . . . 73.32 109.261 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -66.27 -27.83 68.24 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 123.249 0.343 . . . . 64.14 111.002 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -63.46 -48.41 77.82 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.712 . . . . 73.23 110.55 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -83.93 -16.2 45.1 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.001 0.521 . . . . 54.33 111.888 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.6 t -66.27 -21.58 66.29 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.056 0.543 . . . . 72.54 110.354 172.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.78 -21.59 66.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.6 0.76 . . . . 65.52 111.855 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -68.33 -14.15 62.79 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.205 0.602 . . . . 74.54 112.47 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.4 mmt -77.07 85.34 3.57 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.088 0.47 . . . . 65.52 110.352 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -40.79 76.55 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.673 -0.862 . . . . 72.42 108.673 167.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -106.81 164.82 11.79 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.484 -1.235 . . . . 72.35 109.216 170.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.625 ' SG ' HG21 ' A' ' 85' ' ' ILE . 29.3 m 58.93 53.26 5.78 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 124.342 1.026 . . . . 64.52 110.023 -167.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -73.84 -42.16 61.24 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.008 -1.451 . . . . 74.33 111.765 -170.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.482 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 22.5 tptp -74.33 -45.02 49.95 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.208 -0.905 . . . . 71.23 109.867 -170.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -76.23 -22.22 55.46 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 116.026 -0.534 . . . . 70.3 111.24 176.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 t -61.57 -50.92 70.7 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.756 -0.461 . . . . 53.53 109.756 169.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -62.07 -38.7 89.82 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.181 0.925 . . . . 75.4 111.288 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HB3' HH21 ' A' ' 34' ' ' ARG . 4.1 mmp_? -51.06 -61.72 2.06 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.383 0.427 . . . . 64.31 110.01 172.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.62 -46.44 80.93 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.522 1.139 . . . . 71.31 110.887 -175.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.31 -49.89 58.94 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.967 0.792 . . . . 52.2 113.179 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -59.36 -38.13 79.63 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.536 0.735 . . . . 61.35 111.261 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.564 HH21 ' HB3' ' A' ' 30' ' ' ARG . 14.5 mtt180 -60.44 -59.42 5.44 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 123.721 0.638 . . . . 71.23 110.477 175.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.527 HG21 HG21 ' A' ' 14' ' ' ILE . 53.6 t -57.68 -41.07 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 124.516 1.135 . . . . 61.3 111.467 -174.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.17 -43.23 98.86 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.704 0.628 . . . . 70.33 110.053 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.88 -22.55 72.16 Favored Glycine 0 CA--C 1.537 1.43 0 O-C-N 123.448 0.468 . . . . 72.13 113.442 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 39.4 mt -84.35 -44.78 13.44 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 122.833 0.453 . . . . 53.24 110.983 178.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' HA3' ' A' ' 11' ' ' GLY . 13.3 pt -85.17 -25.06 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-O 118.964 -0.541 . . . . 65.24 111.989 -172.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -54.41 -56.01 31.24 Favored Pre-proline 0 CA--C 1.571 1.787 0 C-N-CA 123.598 0.759 . . . . 72.23 112.336 -176.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -72.28 -33.82 8.65 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.025 1.817 . . . . 62.52 111.944 -175.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.473 HD12 HD21 ' A' ' 4' ' ' LEU . 4.4 mm? -65.37 -39.5 92.38 Favored 'General case' 0 C--N 1.352 0.685 0 O-C-N 123.934 0.771 . . . . 75.01 109.497 176.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' HD12 ' A' ' 8' ' ' ILE . 3.7 mm-40 -64.4 -39.92 94.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.107 0.963 . . . . 64.44 111.443 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 31.9 mmt -60.36 -53.52 56.59 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 123.658 0.599 . . . . 71.03 110.549 177.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.6 mt -71.5 -26.6 62.74 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.565 0.746 . . . . 63.41 112.187 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -46.42 26.36 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.964 0.906 . . . . 73.52 109.464 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 . . . . . 0 N--CA 1.482 1.159 0 C-N-CA 123.256 0.623 . . . . 72.22 110.771 -178.494 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 45.2 t . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 108.091 -1.077 . . . . 64.4 108.091 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.45 -44.83 81.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.749 0.42 . . . . 73.54 110.276 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -70.95 -29.16 65.09 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.835 0.854 . . . . 54.12 111.166 176.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.606 ' HB2' ' HB3' ' A' ' 55' ' ' SER . 1.7 tm? -62.17 -48.66 79.07 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 107.825 -1.176 . . . . 72.13 107.825 176.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -64.88 -41.31 95.73 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.94 -1.027 . . . . 71.22 110.587 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.8 m -60.77 -44.66 96.48 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.696 0.623 . . . . 73.41 110.668 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.95 97.53 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.769 0.827 . . . . 52.44 110.102 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.97 -26.11 64.88 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.322 0.649 . . . . 72.42 111.564 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -75.65 -39.49 57.61 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.198 0.599 . . . . 73.51 110.393 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -72.13 -33.29 67.67 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.53 0.732 . . . . 64.21 110.335 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.71 -48.01 64.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.293 1.037 . . . . 74.11 108.785 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -55.47 -53.29 58.12 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 124.592 1.157 . . . . 41.41 110.591 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.67 94.09 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.559 0.743 . . . . 75.02 111.531 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.452 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.65 -36.12 81.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.506 0.722 . . . . 62.23 111.38 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 mt -71.36 -33.59 69.71 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.875 0.47 . . . . 72.23 111.057 177.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -67.05 -34.89 78.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.681 0.392 . . . . 71.43 110.174 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 46.8 mt-10 -64.55 -44.12 91.78 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.626 -0.715 . . . . 74.11 110.741 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.91 -46.73 89.48 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 123.545 0.528 . . . . 74.1 110.646 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -56.87 -44.03 81.84 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.152 1.381 . . . . 74.33 110.22 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.01 -40.43 97.11 Favored Glycine 0 C--N 1.35 1.341 0 O-C-N 124.058 0.849 . . . . 73.51 113.322 178.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 8.4 mm-40 -59.9 -60.29 4.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.946 0.498 . . . . 74.25 110.509 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.554 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.4 pt -66.97 -20.31 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 112.586 0.588 . . . . 74.1 112.586 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -63.4 -48.74 76.58 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.819 -0.808 . . . . 71.44 108.819 171.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.556 ' HG2' HD21 ' A' ' 84' ' ' ASN . 35.0 ttmt -76.18 -25.38 55.16 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.693 -0.685 . . . . 75.11 111.224 -177.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-30 -75.35 -4.38 38.98 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.513 0.725 . . . . 33.4 112.549 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.4 p -57.43 -25.54 59.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.983 0.513 . . . . 65.52 111.42 173.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -90.98 111.93 23.59 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 107.986 -1.116 . . . . 71.12 107.986 169.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -76.56 -29.74 56.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.657 0.783 . . . . 70.34 110.911 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.7 p -69.9 -31.65 69.55 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.035 0.534 . . . . 71.34 110.642 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.556 HD21 ' HG2' ' A' ' 78' ' ' LYS . 41.1 t30 -62.89 -44.44 96.09 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 123.601 0.76 . . . . 71.21 110.172 174.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.625 HG21 ' SG ' ' A' ' 24' ' ' CYS . 34.5 mt -57.17 -55.06 22.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.155 0 O-C-N 124.337 1.023 . . . . 63.02 108.918 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 36.5 t -53.73 -39.94 65.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 124.2 0.938 . . . . 74.22 111.866 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -63.41 -43.77 96.54 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 123.918 0.761 . . . . 71.13 111.585 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -28.35 45.84 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 110.17 -0.307 . . . . 71.51 110.17 177.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.04 -26.5 43.14 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.454 1.102 . . . . 64.11 111.061 -167.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.1 t -76.92 -28.16 55.18 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.882 -0.599 . . . . 74.41 110.412 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.01 -44.69 29.95 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.554 0.742 . . . . 64.01 110.651 178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.0 p . . . . . 0 N--CA 1.473 0.707 0 C-N-CA 123.659 0.784 . . . . 73.11 109.007 177.315 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 137' ' ' ASP . 2.5 mp . . . . . 0 CA--C 1.551 0.991 0 N-CA-C 109.248 -0.649 . . . . 63.13 109.248 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.4 tp -47.53 -42.27 22.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.284 1.033 . . . . 63.42 111.331 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PHE . . . . . 0.554 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 32.7 m-85 -120.73 32.27 6.06 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 114.697 -1.138 . . . . 64.22 111.181 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -48.54 -63.22 1.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.905 0.882 . . . . 74.54 112.792 -175.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.87 -48.91 67.34 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.896 0.879 . . . . 52.24 111.12 -174.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.62 -40.01 85.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 114.713 -1.13 . . . . 62.41 110.981 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -76.95 -28.85 55.36 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.1 0.56 . . . . 64.54 110.74 -176.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -61.88 -40.83 96.76 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 109.045 -0.724 . . . . 74.32 109.045 172.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.64 -48.64 71.5 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 123.762 0.663 . . . . 70.0 111.191 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.452 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -55.3 -47.05 76.16 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.277 0.631 . . . . 64.35 110.534 177.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 33.6 t -65.26 -49.89 67.86 Favored 'General case' 0 C--O 1.212 -0.917 0 O-C-N 124.347 1.03 . . . . 74.22 110.599 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -56.34 -56.38 21.79 Favored 'General case' 0 C--O 1.261 1.669 0 O-C-N 124.224 0.953 . . . . 72.45 110.734 -176.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 47.8 t -62.33 -42.04 93.95 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.185 0 CA-C-N 113.926 -1.488 . . . . 70.15 110.136 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 20.1 t-105 -62.94 -43.46 98.74 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.734 0.646 . . . . 74.12 112.289 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 106' ' ' SER . 47.7 mtmt -59.52 -56.35 23.09 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.783 -0.451 . . . . 74.12 109.783 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.57 -21.76 61.83 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.881 -0.6 . . . . 65.21 111.862 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 3.3 tp -66.35 -60.0 3.17 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 107.158 -1.423 . . . . 64.53 107.158 176.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.8 t -52.72 -41.74 64.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 114.428 -1.26 . . . . 52.21 111.018 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 89.8 mt -58.6 -60.39 3.89 Favored 'General case' 0 C--N 1.361 1.076 0 O-C-N 124.149 0.906 . . . . 65.1 111.346 177.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.31 -27.76 69.25 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 120.698 0.285 . . . . 75.43 111.741 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.575 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 83.1 mt -67.13 -56.56 9.44 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 123.205 0.602 . . . . 74.55 110.389 177.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.71 -31.34 66.63 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.357 0.502 . . . . 63.42 112.357 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 88.1 t -77.13 -57.36 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.438 0.461 . . . . 73.4 110.261 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -97.04 -57.32 2.3 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.099 0.56 . . . . 74.32 111.16 -168.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -1.49 22.0 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.267 0.627 . . . . 62.12 111.37 -175.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 65.62 12.42 8.22 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.632 1.573 . . . . 72.45 112.182 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' MET . . . . . 0.575 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 66.8 mtp -87.01 110.96 37.18 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.176 0.99 . . . . 72.34 110.691 -173.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo . . . . . 0 C--N 1.372 1.78 0 C-N-CA 123.19 2.593 . . . . 64.42 111.4 -177.218 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' TRP . . . . . 0.424 ' HA ' ' HB2' ' A' ' 136' ' ' GLU . 47.4 m0 . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 112.187 0.44 . . . . 75.44 112.187 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.9 74.51 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 122.782 0.433 . . . . 63.22 111.544 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -89.73 -39.69 12.99 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.644 0.778 . . . . 72.12 111.135 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 133' ' ' TRP . 20.5 mm-40 -65.92 -64.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.076 0.55 . . . . 62.02 110.878 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' ASP . . . . . 0.44 ' HB3' HG21 ' A' ' 96' ' ' ILE . 3.7 m-20 -48.14 -36.56 13.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.554 1.142 . . . . 71.43 112.324 178.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -66.83 -58.7 4.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.73 0.812 . . . . 75.1 111.269 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.89 -39.05 87.8 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.445 0.641 . . . . 73.13 110.754 -177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -65.81 -39.29 90.75 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 114.479 -1.237 . . . . 75.2 110.229 176.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.03 -48.9 79.81 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.648 0.379 . . . . 74.25 111.03 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.04 -54.05 51.33 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 124.248 0.967 . . . . 72.34 111.298 177.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -76.6 -21.96 54.86 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.33 0.863 . . . . 74.41 113.33 -172.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ASP . . . . . 0.482 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 32.4 t0 -86.71 -34.55 19.66 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.917 -0.401 . . . . 64.55 109.917 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -65.95 -38.19 87.95 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.043 -0.526 . . . . 72.43 109.985 168.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -64.3 -41.83 96.66 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.37 -0.832 . . . . 71.31 109.576 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.28 -27.57 60.8 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.502 0.721 . . . . 74.43 111.931 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.18 -58.29 3.36 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.461 -0.57 . . . . 64.01 109.461 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -67.59 -44.3 78.45 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.655 -1.157 . . . . 74.14 111.255 -172.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 46.6 ttm -83.7 -79.3 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.33 -0.618 . . . . 72.15 109.33 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 61.0 tp . . . . . 0 N--CA 1.484 1.271 0 C-N-CA 124.457 1.103 . . . . 75.4 111.202 -172.661 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ptp . . . . . 0 N--CA 1.484 1.227 0 CA-C-O 119.648 -0.215 . . . . 72.23 110.804 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.02 -61.48 2.42 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 124.143 0.977 . . . . 75.32 112.855 -168.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -63.69 -37.51 87.63 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.303 0.641 . . . . 71.44 110.441 -174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.646 ' HG ' ' SD ' ' A' ' 62' ' ' MET . 7.4 tt -62.46 -40.73 97.59 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.837 -1.074 . . . . 74.23 109.836 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -68.64 -32.0 71.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.692 0.797 . . . . 74.44 110.519 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -63.98 -40.01 95.42 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-O 119.336 -0.364 . . . . 75.5 110.659 173.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.498 HD13 ' HB3' ' A' ' 65' ' ' PHE . 29.4 mt -59.51 -46.05 93.29 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 CA-C-O 120.979 0.419 . . . . 74.12 110.493 174.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.411 HG12 ' O ' ' A' ' 4' ' ' LEU . 46.1 mm -61.98 -45.7 98.14 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.101 -0.954 . . . . 75.31 111.139 -179.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.7 m -62.75 -53.04 60.44 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.791 0.836 . . . . 65.44 110.248 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 73.6 mt -50.13 -47.24 54.22 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 124.487 1.117 . . . . 73.53 110.221 174.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.444 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.42 -52.81 50.56 Favored Glycine 0 C--N 1.342 0.877 0 O-C-N 124.243 0.964 . . . . 75.14 113.809 -175.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -65.0 -40.28 94.71 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 122.585 0.354 . . . . 71.33 111.286 -179.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.492 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 65.2 t -64.91 -38.52 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 CA-C-N 115.798 -0.637 . . . . 52.21 110.825 176.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.557 HD11 ' O ' ' A' ' 69' ' ' LEU . 20.1 mt -63.65 -51.46 69.84 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.45 1.1 . . . . 74.02 110.079 -178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.512 ' O ' ' HG3' ' A' ' 19' ' ' GLU . 69.8 t60 -54.91 -46.76 74.92 Favored 'General case' 0 CA--C 1.532 0.269 0 O-C-N 124.46 1.1 . . . . 73.31 109.632 177.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 15.1 tptm -62.63 -53.71 50.51 Favored 'General case' 0 CA--C 1.547 0.857 0 O-C-N 124.505 1.128 . . . . 73.43 111.91 -173.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.6 ptp180 -74.48 -22.67 58.97 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.792 0.437 . . . . 64.34 111.772 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.511 ' SG ' HD23 ' A' ' 31' ' ' LEU . 52.4 t -67.0 -26.0 66.58 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.609 0.364 . . . . 50.33 111.292 177.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.512 ' HG3' ' O ' ' A' ' 15' ' ' HIS . 44.4 mt-10 -74.32 5.72 4.3 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 112.966 0.728 . . . . 71.14 112.966 -175.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.479 ' HG3' ' NH1' ' A' ' 82' ' ' ARG . 14.8 pt-20 -86.15 -13.85 45.87 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.687 0.395 . . . . 74.34 111.439 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.527 ' HA ' ' HD2' ' A' ' 82' ' ' ARG . 14.2 mmt -76.24 95.07 3.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 122.846 0.458 . . . . 55.51 110.452 -176.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -73.07 -32.64 65.14 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.321 0.582 . . . . 74.24 109.937 173.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -94.61 153.8 17.67 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.335 -0.987 . . . . 71.14 108.335 166.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' HD11 ' A' ' 97' ' ' LEU . 95.3 m 60.51 55.33 3.46 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 124.131 0.894 . . . . 70.11 110.342 -170.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -69.81 -48.2 59.96 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-N 115.183 -0.917 . . . . 63.14 111.022 -176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.3 mtpm? -72.7 -32.99 66.18 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 122.881 0.472 . . . . 74.44 110.421 -173.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG2' HH12 ' A' ' 30' ' ' ARG . 48.0 mt-30 -71.64 -31.09 66.47 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.368 0.267 . . . . 74.44 111.174 172.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.6 t -67.41 -39.44 85.53 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.257 0.623 . . . . 63.54 110.532 173.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 -74.4 -32.12 62.59 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 114.849 -1.069 . . . . 72.12 110.749 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.567 HH12 ' HG2' ' A' ' 27' ' ' GLN . 40.0 ttp-105 -77.61 -39.91 43.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.32 0.648 . . . . 74.41 110.205 -178.333 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.511 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.6 tp -61.25 -47.14 87.38 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 108.713 -0.847 . . . . 73.11 108.713 172.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.37 -41.09 98.34 Favored Glycine 0 C--N 1.351 1.415 0 O-C-N 123.928 0.767 . . . . 54.53 113.004 176.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -59.98 -51.85 67.92 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.063 0.945 . . . . 74.44 110.677 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.584 ' NH2' ' HB3' ' A' ' 133' ' ' TRP . 34.9 mtt180 -59.78 -62.39 1.91 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 114.201 -1.363 . . . . 72.51 110.632 178.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 40.4 t -51.13 -46.31 31.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 124.453 1.096 . . . . 44.23 111.951 -173.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.559 HD23 HD11 ' A' ' 39' ' ' ILE . 94.7 mt -67.46 -44.25 79.1 Favored 'General case' 0 CA--C 1.544 0.731 0 O-C-N 123.415 0.447 . . . . 64.2 110.745 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -63.38 -19.44 62.13 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.266 0.354 . . . . 75.33 113.741 175.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 81.0 mt -86.69 -52.58 5.44 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.825 0.85 . . . . 71.35 111.995 177.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.559 HD11 HD23 ' A' ' 36' ' ' LEU . 12.7 pt -73.99 -46.69 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 CA-C-O 118.758 -0.639 . . . . 72.23 111.769 -169.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.502 ' HE2' ' HB3' ' A' ' 36' ' ' LEU . 68.3 mttm -53.57 -50.22 84.38 Favored Pre-proline 0 N--CA 1.489 1.506 0 CA-C-O 118.416 -0.802 . . . . 63.13 113.094 -173.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.489 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 49.4 Cg_exo -55.87 -54.02 4.7 Favored 'Trans proline' 0 C--N 1.395 3.005 0 C-N-CA 121.963 1.775 . . . . 43.41 112.045 176.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HA ' HD12 ' A' ' 45' ' ' LEU . 4.3 mm? -64.39 -23.36 67.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.488 0.715 . . . . 62.23 111.647 -176.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.439 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 45.7 mt-10 -71.65 -44.18 64.77 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.739 0.816 . . . . 71.13 110.572 172.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.444 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 32.7 mmt -69.55 -26.89 64.71 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.529 0.518 . . . . 73.2 110.983 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' A' ' 42' ' ' LEU . 39.2 mt -78.61 -37.14 43.02 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.968 0.907 . . . . 64.03 109.987 176.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -68.84 -32.63 72.45 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 115.648 -0.705 . . . . 73.52 110.123 174.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -69.17 -52.82 24.13 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.404 1.082 . . . . 73.35 110.907 -179.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -68.31 -25.87 65.35 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.918 -0.583 . . . . 75.1 110.841 -179.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.56 99.91 1.41 Allowed Glycine 0 C--N 1.349 1.276 0 CA-C-N 115.963 -0.562 . . . . 45.13 112.308 176.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -85.87 119.7 26.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 107.925 -1.139 . . . . 73.04 107.925 177.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -55.18 129.87 39.87 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.098 0.959 . . . . 72.34 112.431 -179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.7 m -78.6 84.36 4.72 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 123.401 0.68 . . . . 64.53 110.217 176.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 4.4 p -167.59 75.98 0.96 Allowed Pre-proline 0 CA--C 1.556 1.176 0 CA-C-N 114.721 -1.127 . . . . 60.43 108.903 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -86.13 109.86 1.0 Allowed 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 122.489 2.126 . . . . 44.21 112.484 177.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.473 ' H ' HD12 ' A' ' 58' ' ' LEU . 4.5 m -62.26 172.58 1.42 Allowed 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.065 0.946 . . . . 74.11 110.609 171.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.06 -42.73 77.09 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.796 0.438 . . . . 63.33 110.075 175.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.48 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.53 -45.68 88.38 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.09 -0.959 . . . . 64.33 111.75 176.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.473 HD12 ' H ' ' A' ' 55' ' ' SER . 97.6 mt -74.14 -37.08 64.15 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.816 0.846 . . . . 72.23 111.115 -172.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 67.0 m -62.6 -55.46 26.9 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 123.95 0.781 . . . . 71.41 109.203 175.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 26.4 m -62.89 -36.03 81.97 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-N 115.755 -0.657 . . . . 74.41 111.246 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.53 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.08 -48.93 74.27 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.388 0.675 . . . . 53.12 111.016 -179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.646 ' SD ' ' HG ' ' A' ' 4' ' ' LEU . 32.8 mmt -68.54 -30.08 68.79 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.548 -0.751 . . . . 72.34 111.992 177.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -76.37 -36.72 57.99 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.537 0.335 . . . . 70.43 111.165 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 73.5 mtp85 -67.41 -41.92 84.1 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.604 0.762 . . . . 71.45 109.512 177.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.513 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.0 OUTLIER -67.03 -49.41 65.32 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.364 -0.834 . . . . 65.41 109.511 -179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.3 ttpp -53.59 -51.69 62.19 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 123.619 0.574 . . . . 73.1 110.267 178.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.45 -39.98 89.51 Favored 'General case' 0 N--CA 1.473 0.699 0 O-C-N 124.263 0.977 . . . . 74.13 112.093 -178.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.559 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.97 -44.5 92.56 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.755 0.822 . . . . 62.32 111.102 177.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.557 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -69.77 -29.45 66.79 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 115.247 -0.888 . . . . 75.42 110.708 176.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.7 mt-10 -65.76 -38.48 89.19 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.584 -0.697 . . . . 61.14 109.856 175.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.441 ' HB2' HG13 ' A' ' 101' ' ' VAL . 44.0 mt-10 -61.84 -52.2 65.13 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.45 -0.795 . . . . 73.42 110.144 174.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -57.21 -41.7 79.93 Favored 'General case' 0 N--CA 1.486 1.345 0 O-C-N 123.876 0.735 . . . . 74.11 111.367 -178.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -59.64 -48.3 82.2 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.698 1.199 . . . . 61.31 110.645 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.28 -35.23 91.71 Favored Glycine 0 C--N 1.348 1.25 0 CA-C-N 115.195 -0.911 . . . . 35.31 113.18 178.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.0 mm-40 -67.77 -54.01 22.65 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-O 119.073 -0.489 . . . . 73.24 110.95 -177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.462 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -63.31 -33.71 62.79 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 112.02 0.378 . . . . 72.15 112.02 177.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -65.16 -33.22 75.5 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 120.973 0.416 . . . . 71.53 110.262 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -80.73 -27.78 36.78 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.5 0.72 . . . . 41.42 110.855 175.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.402 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.3 m-85 -87.1 9.4 19.96 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.004 0.922 . . . . 73.45 111.32 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 89.2 p -57.16 -16.79 8.68 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.073 0.949 . . . . 72.32 112.306 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -110.3 115.14 29.15 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 108.027 -1.101 . . . . 72.44 108.027 167.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.527 ' HD2' ' HA ' ' A' ' 21' ' ' MET . 1.0 OUTLIER -72.82 -24.65 60.93 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.423 0.689 . . . . 61.02 111.373 178.652 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.6 p -64.95 -37.47 87.75 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 123.311 0.644 . . . . 63.24 110.326 170.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -66.79 -38.28 86.21 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.856 0.862 . . . . 65.32 110.601 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.486 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.2 mt -57.7 -49.16 81.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 108.862 -0.792 . . . . 74.12 108.862 175.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 43.5 t -63.01 -35.08 79.02 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.425 0.453 . . . . 74.15 111.606 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -60.8 -45.11 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 O-C-N 123.699 0.624 . . . . 74.42 111.054 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.411 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -80.54 -27.51 37.56 Favored 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 110.384 -0.228 . . . . 62.22 110.384 177.386 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.486 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 14.6 tp -67.61 -44.25 78.5 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.518 1.127 . . . . 52.15 111.164 -171.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.5 t -65.63 -13.58 59.41 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 114.868 -1.06 . . . . 74.31 111.65 -179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -109.26 -21.75 12.4 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.082 0.953 . . . . 74.31 111.402 175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.1 t -68.65 113.44 6.15 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.948 0.899 . . . . 53.11 110.147 -175.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -69.0 -33.99 74.56 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.26 1.024 . . . . 51.41 111.091 -177.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -83.16 148.27 27.56 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.757 -0.831 . . . . 70.44 108.757 170.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -96.49 18.58 13.74 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 74.04 110.84 -175.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.541 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 7.0 mt -124.14 128.72 74.13 Favored 'Isoleucine or valine' 0 C--O 1.242 0.696 0 C-N-CA 124.33 1.052 . . . . 71.11 108.259 -178.086 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.557 HD11 ' SG ' ' A' ' 24' ' ' CYS . 20.2 mt -65.87 -54.1 31.11 Favored 'General case' 0 N--CA 1.476 0.826 0 CA-C-O 122.142 0.972 . . . . 73.21 109.621 177.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.478 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 21.9 m-85 -94.44 36.72 1.14 Allowed 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.628 -1.624 . . . . 74.24 109.947 -174.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.541 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 1.6 tmmt? -52.53 -62.46 1.63 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 118.152 0.433 . . . . 74.35 110.844 -176.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -61.85 -60.84 3.05 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.262 0.625 . . . . 74.43 110.802 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.9 t -50.34 -57.85 2.13 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 124.898 1.279 . . . . 64.42 112.807 -174.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.458 ' HA ' HD13 ' A' ' 105' ' ' LEU . 65.3 t30 -73.83 -22.25 59.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 114.985 -1.007 . . . . 64.44 110.349 -174.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 9.9 tpt180 -60.1 -43.65 95.39 Favored 'General case' 0 C--N 1.357 0.897 0 CA-C-O 119.203 -0.427 . . . . 73.25 110.126 166.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -56.75 -46.91 81.11 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-O 119.386 -0.34 . . . . 71.21 110.665 172.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.559 HD12 ' HB1' ' A' ' 68' ' ' ALA . 9.9 mp -53.21 -41.66 65.55 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 117.784 0.265 . . . . 52.2 111.142 175.387 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.439 ' HA ' ' HE3' ' A' ' 133' ' ' TRP . 38.9 t -67.53 -43.94 79.56 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.884 0.874 . . . . 43.45 111.577 -178.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 68.7 m-20 -69.79 -55.16 10.59 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.411 -0.813 . . . . 72.35 110.243 -177.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.407 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.7 t -63.28 -32.75 57.6 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.696 0 CA-C-O 119.532 -0.271 . . . . 54.53 111.225 -176.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.614 ' HH2' HG12 ' A' ' 124' ' ' VAL . 16.4 t-105 -67.46 -48.18 67.95 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 119.02 -0.514 . . . . 74.44 111.738 174.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.54 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 41.4 pttt -60.72 -42.09 96.58 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 109.327 -0.62 . . . . 74.44 109.327 -177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -69.39 -35.56 75.91 Favored 'General case' 0 C--N 1.354 0.793 0 C-N-CA 124.391 1.076 . . . . 71.53 110.607 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.53 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.3 OUTLIER -61.14 -59.81 4.74 Favored 'General case' 0 C--N 1.358 0.945 0 N-CA-C 107.948 -1.131 . . . . 65.21 107.948 178.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 13.9 t -53.97 -35.49 61.87 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 113.905 -1.498 . . . . 62.41 110.973 -176.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.2 mt -63.22 -62.95 1.35 Allowed 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.154 0.582 . . . . 62.41 111.533 172.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.48 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 3.8 pp -63.19 -28.61 70.16 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.134 0.42 . . . . 73.13 112.134 -173.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 91.7 mt -65.28 -57.9 7.28 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 115.292 -0.867 . . . . 72.34 109.878 173.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -68.17 -23.72 64.89 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 112.18 0.437 . . . . 72.34 112.18 -174.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 85.4 t -83.94 -63.96 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 C-N-CA 122.376 0.271 . . . . 71.21 111.003 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -93.87 -44.48 8.08 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 122.253 -0.279 . . . . 52.35 111.537 -170.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -71.21 -17.63 62.51 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 116.674 -0.239 . . . . 73.15 110.481 173.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 65.82 9.73 6.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 125.741 1.617 . . . . 74.21 111.363 -177.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.537 ' HG2' HG23 ' A' ' 124' ' ' VAL . 33.1 ttp -94.61 111.12 52.81 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.476 1.11 . . . . 75.35 109.432 -170.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 41.2 Cg_endo -90.41 43.85 0.55 Allowed 'Trans proline' 0 C--N 1.366 1.465 0 C-N-CA 124.004 3.136 . . . . 72.24 112.915 -165.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.614 HG12 ' HH2' ' A' ' 109' ' ' TRP . 86.6 t -65.75 103.16 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 124.043 0.937 . . . . 64.43 111.285 -175.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 39.9 t -162.0 79.45 1.98 Allowed Pre-proline 0 CA--C 1.546 0.824 0 CA-C-N 114.386 -1.279 . . . . 72.23 108.108 172.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.489 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 61.4 Cg_endo -81.79 27.21 0.59 Allowed 'Trans proline' 0 C--N 1.375 1.934 0 C-N-CA 123.156 2.571 . . . . 64.43 112.775 177.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.427 HD11 ' HE1' ' A' ' 133' ' ' TRP . 13.3 tt -145.24 -58.59 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 122.562 0.345 . . . . 73.44 111.582 -168.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 29.7 p -175.82 -68.1 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.28 0.632 . . . . 74.4 109.854 -174.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.73 -57.16 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 107.028 -1.471 . . . . 71.41 107.028 -174.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.67 -7.04 10.39 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.977 -1.01 . . . . 43.24 113.909 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -80.17 -39.28 29.62 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 117.661 0.731 . . . . 51.22 111.138 176.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.9 m -62.92 -13.11 30.39 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.65 1.18 . . . . 30.33 112.605 179.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.584 ' HB3' ' NH2' ' A' ' 34' ' ' ARG . 12.3 m0 -58.82 -18.04 28.96 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.122 1.369 . . . . 75.53 113.983 176.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -64.23 -39.35 93.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.289 0.236 . . . . 65.13 110.792 172.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -72.58 -32.34 65.93 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.393 0.677 . . . . 64.15 111.319 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HG2' ' HD2' ' A' ' 30' ' ' ARG . 29.4 tt0 -61.99 -58.67 6.99 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.694 0.798 . . . . 75.32 109.973 -179.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -61.0 -37.83 83.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.061 0.544 . . . . 75.1 111.835 178.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 142' ' ' ASP . 33.3 tt0 -56.01 -63.76 1.08 Allowed 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.79 0.681 . . . . 73.4 110.948 179.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -71.46 -46.19 60.6 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.524 0.515 . . . . 73.44 110.862 -172.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -69.94 -43.01 72.48 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.923 -0.58 . . . . 61.44 111.129 -170.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.409 ' HB3' HG12 ' A' ' 96' ' ' ILE . . . -78.05 -25.36 47.71 Favored 'General case' 0 N--CA 1.478 0.963 0 O-C-N 123.212 0.32 . . . . 71.2 111.096 179.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 138' ' ' GLN . 13.6 t70 -58.21 -53.72 55.1 Favored 'General case' 0 N--CA 1.483 1.207 0 N-CA-C 109.318 -0.623 . . . . 70.22 109.318 170.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 78.7 mm-40 -58.65 -44.61 90.16 Favored 'General case' 0 C--N 1.354 0.761 0 CA-C-N 114.341 -1.3 . . . . 72.41 111.693 177.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.513 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 34.0 t70 -80.88 -32.25 34.97 Favored 'General case' 0 N--CA 1.481 1.108 0 O-C-N 123.952 0.782 . . . . 72.43 112.87 -168.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.416 ' HG2' HD11 ' A' ' 89' ' ' LEU . 3.6 tmt_? -70.2 -41.33 73.82 Favored 'General case' 0 N--CA 1.484 1.244 0 N-CA-C 108.288 -1.005 . . . . 74.44 108.288 174.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.9 ttm180 -62.42 -37.44 85.83 Favored 'General case' 0 C--O 1.215 -0.755 0 CA-C-N 114.726 -1.124 . . . . 73.23 109.954 171.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.87 -17.82 59.65 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.438 0.695 . . . . 73.34 111.396 179.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.488 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 1.6 t80 -69.98 -59.81 2.69 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.238 -1.023 . . . . 63.35 108.238 171.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.92 -38.65 72.95 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 113.874 -1.512 . . . . 52.33 111.595 -170.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 87.4 mmm -103.55 31.7 4.25 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.196 0.999 . . . . 71.23 110.131 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 154' ' ' ASP . 2.0 tt -76.38 84.91 3.14 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-O 121.583 0.706 . . . . 65.21 109.574 -179.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 5.4 ppt_? -116.36 -11.46 11.21 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.68 1.192 . . . . 74.53 109.423 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -61.05 -48.98 79.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.289 1.436 . . . . 64.54 111.964 -177.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.543 ' HB3' HD21 ' A' ' 151' ' ' LEU . 39.1 t70 -91.08 25.54 2.43 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-O 121.982 0.896 . . . . 71.23 109.987 -178.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -122.94 81.58 1.89 Allowed 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.666 -0.865 . . . . 63.41 108.666 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 . . . . . 0 CA--C 1.561 1.372 0 C-N-CA 125.328 1.451 . . . . 74.02 111.846 -177.413 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.238 0 N-CA-C 110.255 -0.276 . . . . 74.41 110.255 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -63.27 -55.24 26.41 Favored 'General case' 0 C--N 1.358 0.963 0 C-N-CA 124.055 0.942 . . . . 64.44 111.238 -175.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -59.65 -35.03 73.6 Favored 'General case' 0 N--CA 1.483 1.176 0 O-C-N 123.784 0.677 . . . . 73.44 111.562 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 30.5 tp -66.71 -44.56 81.35 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 122.888 0.475 . . . . 65.31 110.549 178.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -70.21 -25.35 63.36 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.791 0.436 . . . . 74.23 110.633 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 29.2 m-70 -77.64 -29.96 51.98 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-O 118.993 -0.527 . . . . 72.13 110.768 173.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 69.5 mt -60.46 -44.91 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 109.2 -0.667 . . . . 74.43 109.2 170.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 32.3 mm -60.42 -51.52 72.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 CA-C-N 114.5 -1.227 . . . . 64.54 110.842 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.8 m -65.09 -56.77 11.09 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 123.329 0.652 . . . . 65.33 111.075 -175.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 70.2 mt -51.7 -51.54 55.22 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.965 0.906 . . . . 72.3 111.199 178.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -66.26 -35.24 90.06 Favored Glycine 0 C--N 1.346 1.126 0 O-C-N 124.272 0.983 . . . . 74.12 114.05 -175.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -69.16 -42.8 75.44 Favored 'General case' 0 C--O 1.246 0.894 0 CA-C-O 121.22 0.533 . . . . 65.13 109.729 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 62.8 t -62.06 -37.72 79.07 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-N 114.923 -1.035 . . . . 74.13 110.139 174.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.457 HG12 HD11 ' A' ' 76' ' ' ILE . 32.8 mt -58.04 -52.21 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 123.758 0.823 . . . . 73.14 110.131 176.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.1 t-80 -60.16 -36.29 77.23 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 124.004 0.815 . . . . 73.32 110.982 -179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -66.29 -66.98 0.48 Allowed 'General case' 0 CA--C 1.547 0.831 0 CA-C-O 119.541 -0.266 . . . . 71.34 111.454 175.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -63.78 -20.17 65.56 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.355 0.872 . . . . 73.25 113.355 -172.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 21' ' ' MET . 48.5 t -65.33 -20.53 66.44 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.067 0.547 . . . . 72.21 112.077 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -58.28 -18.07 24.13 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.781 0.832 . . . . 65.23 113.07 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -65.85 -21.51 66.47 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.337 0.866 . . . . 62.31 113.337 -179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.525 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 7.6 mmt -75.57 87.7 2.68 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 121.16 0.505 . . . . 54.14 110.493 -173.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.26 -35.59 63.79 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 114.787 -1.097 . . . . 70.41 108.447 170.146 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -92.64 152.89 19.31 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 108.129 -1.063 . . . . 71.2 108.129 169.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 31.5 p 50.54 60.11 4.09 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.243 1.017 . . . . 45.13 110.413 -171.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 47.4 mtmt -66.58 -45.32 79.62 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 114.491 -1.231 . . . . 61.21 111.371 -174.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -71.42 -36.8 71.43 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 108.194 -1.039 . . . . 72.0 108.194 -170.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.479 HE22 ' HB2' ' A' ' 141' ' ' ALA . 0.0 OUTLIER -56.45 -43.86 79.94 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.066 1.346 . . . . 73.01 112.231 169.092 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 32.8 t -60.94 -39.79 90.83 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.683 0.793 . . . . 72.34 110.889 177.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.9 mpt_? -81.23 -22.44 38.76 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.628 0.771 . . . . 74.54 111.1 179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.45 -60.45 2.3 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.632 0.773 . . . . 73.3 109.166 179.355 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 29.0 tp -58.23 -40.52 81.9 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.425 1.09 . . . . 73.43 110.196 173.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.04 -51.04 59.73 Favored Glycine 0 C--N 1.354 1.54 0 O-C-N 123.965 0.791 . . . . 71.15 112.458 177.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -71.59 -32.99 68.65 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.082 0.553 . . . . 74.4 111.387 -179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.796 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.9 mtt180 -62.37 -63.58 1.19 Allowed 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.419 0.449 . . . . 61.42 109.812 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 14' ' ' ILE . 99.8 t -65.09 -41.14 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-N 115.549 -0.75 . . . . 72.44 111.219 -173.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 28.5 tp -62.8 -40.94 98.9 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.344 0.592 . . . . 73.31 109.893 175.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.1 -22.09 75.84 Favored Glycine 0 C--O 1.216 -1.006 0 CA-C-N 114.702 -1.135 . . . . 51.21 113.083 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.512 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 90.5 mt -84.42 -39.7 18.68 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-N 117.838 0.819 . . . . 62.31 111.372 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 9.0 pt -81.66 -39.18 16.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 112.447 0.536 . . . . 74.53 112.447 -173.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.454 ' O ' ' HG2' ' A' ' 44' ' ' MET . 31.2 mmtp -60.07 -53.79 61.7 Favored Pre-proline 0 N--CA 1.485 1.304 0 CA-C-O 118.004 -0.998 . . . . 71.4 112.518 -174.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 45' ' ' LEU . 27.2 Cg_endo -60.17 -41.26 52.95 Favored 'Trans proline' 0 C--N 1.399 3.222 0 C-N-CA 122.08 1.853 . . . . 72.23 110.539 177.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.46 HD13 HD11 ' A' ' 45' ' ' LEU . 3.9 mm? -60.67 -35.66 76.8 Favored 'General case' 0 C--N 1.356 0.868 0 O-C-N 124.286 0.991 . . . . 75.21 111.667 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -70.16 -44.9 67.84 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.798 0.439 . . . . 73.43 110.943 176.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.454 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 36.2 mmt -57.13 -51.76 68.02 Favored 'General case' 0 C--N 1.353 0.725 0 O-C-N 124.099 0.874 . . . . 74.34 110.265 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 41' ' ' PRO . 3.5 pp -77.16 -27.5 53.82 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 116.203 -0.453 . . . . 71.15 111.721 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -59.45 -39.14 82.64 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.654 0.661 . . . . 72.44 110.153 174.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -82.32 -45.04 15.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.157 -0.929 . . . . 62.43 111.562 -177.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -78.19 -58.86 3.03 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.964 0.505 . . . . 70.1 111.589 -176.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -176.15 91.87 0.09 OUTLIER Glycine 0 C--N 1.346 1.107 0 N-CA-C 112.162 -0.375 . . . . 65.54 112.162 -176.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 11.6 tptp -90.03 -32.34 16.79 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.463 1.105 . . . . 73.33 110.988 179.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 52.2 mtt180 75.18 110.47 0.07 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.857 1.663 . . . . 71.24 109.556 -164.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.8 p -76.81 -171.28 1.87 Allowed 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.799 -1.091 . . . . 62.23 111.031 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 58.1 t 61.43 83.94 0.2 Allowed Pre-proline 0 C--O 1.244 0.765 0 C-N-CA 124.627 1.171 . . . . 73.51 109.566 -172.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.571 ' HA ' HD23 ' A' ' 58' ' ' LEU . 58.7 Cg_endo -71.93 128.09 13.67 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 121.928 1.752 . . . . 72.12 111.341 179.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 p -64.96 169.18 5.52 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.387 0.675 . . . . 64.21 110.321 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -57.09 -51.33 69.74 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.15 0.58 . . . . 71.12 110.918 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.406 ' H ' ' HG3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -72.25 -27.25 62.39 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.33 -0.85 . . . . 55.44 111.883 -179.169 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.571 HD23 ' HA ' ' A' ' 54' ' ' PRO . 52.8 tp -72.55 -43.6 63.25 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.885 -0.413 . . . . 71.44 109.885 178.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 73.3 m -62.17 -49.68 74.85 Favored 'General case' 0 C--N 1.347 0.466 0 C-N-CA 123.787 0.835 . . . . 74.11 109.36 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 54.8 m -54.71 -44.93 73.89 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.038 0.935 . . . . 74.13 110.826 176.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.484 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.89 -38.57 89.09 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.634 0.774 . . . . 63.14 111.198 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.2 mmt -70.82 -30.44 66.87 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.914 0.485 . . . . 72.51 111.007 178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -68.33 -45.99 71.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.039 0.536 . . . . 74.11 109.87 174.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 53.6 mtp85 -67.91 -39.38 83.58 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.469 -0.787 . . . . 73.53 111.32 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.415 ' CZ ' HD13 ' A' ' 38' ' ' LEU . 1.2 t80 -68.47 -46.42 69.81 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.154 0.982 . . . . 71.1 109.531 -178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -60.94 -44.83 96.7 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.894 1.278 . . . . 73.41 111.036 176.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.3 -38.47 90.31 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.235 0.614 . . . . 74.42 111.083 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.571 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.85 -33.93 76.68 Favored 'General case' 0 C--O 1.241 0.645 0 CA-C-N 115.335 -0.848 . . . . 51.22 110.947 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 88.7 mt -69.74 -35.82 75.31 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.944 -0.571 . . . . 73.14 110.994 174.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.07 -38.56 91.51 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 122.951 0.5 . . . . 71.11 110.981 176.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.24 -51.4 67.91 Favored 'General case' 0 N--CA 1.478 0.948 0 O-C-N 123.959 0.787 . . . . 74.3 109.943 175.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.63 -35.85 79.08 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.597 0.759 . . . . 62.41 111.537 178.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -69.05 -41.58 77.45 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.773 1.229 . . . . 53.42 110.358 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.08 -33.8 65.04 Favored Glycine 0 C--N 1.347 1.171 0 CA-C-N 115.109 -0.951 . . . . 61.12 112.224 177.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 43.6 mm-40 -62.69 -50.85 69.51 Favored 'General case' 0 C--O 1.213 -0.851 0 C-N-CA 123.089 0.556 . . . . 52.12 111.408 177.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.543 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -71.98 -28.01 28.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 112.231 0.456 . . . . 70.53 112.231 178.376 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.435 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 39.5 tt0 -62.83 -36.72 84.13 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.668 0.747 . . . . 52.42 109.583 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -77.8 -39.13 44.9 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 114.359 -1.291 . . . . 74.52 110.698 176.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.543 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 15.1 m-30 -76.59 -3.52 38.06 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 124.309 1.044 . . . . 61.51 112.081 -177.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.4 p -56.04 -31.36 63.06 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 121.507 0.67 . . . . 70.34 109.765 171.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 -87.21 104.64 16.56 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.438 -1.319 . . . . 73.41 107.438 166.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.58 -22.43 64.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.417 0.687 . . . . 70.25 110.724 179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.7 m -58.62 -39.4 80.36 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.305 1.042 . . . . 65.3 110.966 170.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -64.13 -41.38 97.23 Favored 'General case' 0 C--O 1.245 0.866 0 C-N-CA 124.151 0.98 . . . . 64.24 110.818 177.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 29.0 mt -58.78 -51.17 75.35 Favored 'Isoleucine or valine' 0 C--N 1.362 1.11 0 O-C-N 123.956 0.785 . . . . 65.22 109.402 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 48.3 t -55.67 -46.18 77.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.88 0.872 . . . . 62.41 111.522 178.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -59.32 -42.96 92.64 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.662 -1.154 . . . . 64.14 111.832 -176.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -85.31 -24.89 27.48 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 119.305 -0.379 . . . . 73.34 110.513 178.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 16.5 tp -67.46 -39.27 85.32 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.493 0.717 . . . . 71.14 110.859 -172.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.8 t -65.81 -26.15 67.55 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 115.363 -0.835 . . . . 54.14 111.18 175.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.15 -3.99 30.59 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.157 0.983 . . . . 73.12 111.64 178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 30.5 t -73.71 126.96 31.5 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 109.633 -0.506 . . . . 75.34 109.633 -175.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -86.4 -2.17 58.2 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.326 -0.852 . . . . 74.33 111.674 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -136.45 171.61 14.23 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.126 0.489 . . . . 72.5 109.941 174.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -83.56 -36.31 24.09 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.077 0.951 . . . . 70.35 110.599 -177.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.529 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.3 mp -80.01 127.87 38.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 108.858 -0.793 . . . . 74.21 108.858 -175.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 98' ' ' PHE . 39.1 mt -61.95 -43.65 98.4 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-O 121.829 0.823 . . . . 72.24 110.41 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.4 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 12.7 m-85 -105.58 45.31 0.98 Allowed 'General case' 0 C--O 1.218 -0.595 0 CA-C-N 114.143 -1.39 . . . . 73.01 108.933 -177.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.15 -66.72 0.35 Allowed 'General case' 0 N--CA 1.488 1.431 0 CA-C-N 118.483 0.583 . . . . 72.52 110.35 -170.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.403 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 36.1 t70 -73.07 -41.04 64.55 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.713 0.633 . . . . 74.13 111.028 -176.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 98.6 t -55.42 -58.56 4.19 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 O-C-N 123.839 0.712 . . . . 75.4 110.902 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -74.95 -20.79 59.53 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.979 0.912 . . . . 61.33 111.274 -176.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -64.42 -37.12 86.42 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 108.936 -0.765 . . . . 74.3 108.936 167.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 61.1 mtpt -71.75 -37.01 70.59 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.2 0.6 . . . . 73.11 110.721 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.571 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -58.35 -47.44 83.78 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 109.938 -0.393 . . . . 74.14 109.938 171.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.796 ' HB2' HH12 ' A' ' 34' ' ' ARG . 35.1 t -66.55 -38.97 88.25 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.744 0.818 . . . . 75.44 111.362 -177.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.749 ' HA ' ' HE3' ' A' ' 110' ' ' LYS . 39.1 t70 -69.4 -55.46 10.28 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.007 0.923 . . . . 55.51 110.197 -175.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 46.8 t -67.44 -22.84 29.22 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-N 115.22 -0.9 . . . . 64.13 110.598 178.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.412 ' HH2' HG21 ' A' ' 124' ' ' VAL . 43.8 t-105 -70.56 -38.14 74.1 Favored 'General case' 0 C--N 1.354 0.778 0 CA-C-O 118.907 -0.568 . . . . 71.34 111.153 171.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.749 ' HE3' ' HA ' ' A' ' 107' ' ' ASP . 10.0 mtmp? -58.92 -47.3 85.49 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-N 118.536 0.607 . . . . 72.21 110.085 172.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 12.6 mm-40 -58.02 -49.87 75.37 Favored 'General case' 0 C--O 1.244 0.806 0 O-C-N 124.329 1.018 . . . . 72.53 110.332 -179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.484 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.8 OUTLIER -54.75 -61.72 2.13 Favored 'General case' 0 C--N 1.353 0.719 0 O-C-N 124.258 0.974 . . . . 54.32 109.727 176.521 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 46.7 t -53.47 -39.59 64.63 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.541 1.136 . . . . 65.55 112.091 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.56 -60.41 3.38 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.969 0.507 . . . . 71.24 111.125 177.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.547 HD11 HD13 ' A' ' 58' ' ' LEU . 4.1 pp -65.26 -37.16 86.36 Favored 'General case' 0 CA--C 1.559 1.297 0 CA-C-O 120.877 0.37 . . . . 51.43 111.492 -173.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.649 HD22 ' SD ' ' A' ' 122' ' ' MET . 95.1 mt -65.39 -49.11 70.52 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.185 0.994 . . . . 61.41 111.131 179.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -73.83 -40.06 63.6 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 112.454 0.538 . . . . 62.44 112.454 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 78.9 t -71.5 -53.56 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 122.582 0.353 . . . . 71.12 111.06 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -87.66 -57.68 2.85 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.079 0.466 . . . . 54.4 111.284 -172.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.47 HE22 HD22 ' A' ' 58' ' ' LEU . 64.8 mt-30 -84.66 -13.2 52.2 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.348 -0.842 . . . . 65.03 111.336 -172.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 60.82 35.32 19.47 Favored 'General case' 0 C--N 1.364 1.206 0 C-N-CA 124.765 1.226 . . . . 74.23 112.016 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.649 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.4 mtp -78.06 112.77 27.76 Favored Pre-proline 0 CA--C 1.544 0.746 0 CA-C-N 115.262 -0.881 . . . . 75.33 109.952 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -81.78 105.56 1.55 Allowed 'Trans proline' 0 C--N 1.369 1.647 0 C-N-CA 122.703 2.269 . . . . 62.45 110.637 -179.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.469 HG22 ' HD3' ' A' ' 126' ' ' PRO . 11.6 p -130.98 109.35 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-O 122.091 0.948 . . . . 65.14 110.626 -176.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.3 t -143.78 71.97 17.1 Favored Pre-proline 0 CA--C 1.55 0.975 0 CA-C-N 115.145 -0.934 . . . . 72.3 109.017 176.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.469 ' HD3' HG22 ' A' ' 124' ' ' VAL . 25.9 Cg_endo -91.51 -2.44 4.48 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 123.322 2.682 . . . . 71.12 113.751 176.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 40.7 pt -129.85 -155.29 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.865 0 C-N-CA 124.189 0.995 . . . . 72.01 109.342 -170.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 88.6 p -73.17 -155.82 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.728 0.811 . . . . 73.44 110.899 172.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.4 -46.12 87.02 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.232 1.013 . . . . 64.51 109.185 170.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.33 -27.91 6.2 Favored Glycine 0 C--N 1.346 1.113 0 CA-C-N 115.854 -0.612 . . . . 63.04 112.232 -178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -75.25 -42.55 54.91 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.446 -0.575 . . . . 54.52 109.446 172.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 14.5 m -63.23 -18.84 63.97 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.453 1.101 . . . . 71.04 112.366 178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.406 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER -58.48 -30.73 67.21 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 125.201 1.4 . . . . 74.11 111.752 -173.968 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -75.42 -40.37 57.83 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.325 0.65 . . . . 40.21 111.282 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 27.0 tt0 -64.24 -39.26 93.59 Favored 'General case' 0 C--O 1.246 0.914 0 C-N-CA 123.791 0.836 . . . . 71.31 110.668 178.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -52.16 -57.05 10.81 Favored 'General case' 0 C--O 1.214 -0.775 0 O-C-N 124.6 1.188 . . . . 75.21 110.881 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -69.25 -35.71 76.39 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 124.343 1.027 . . . . 71.35 113.542 -171.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -72.1 -37.56 69.53 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 118.558 0.617 . . . . 72.44 111.049 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -75.73 -36.35 59.95 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.417 0.627 . . . . 64.42 110.517 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 143' ' ' GLU . 14.2 t70 -62.18 -48.49 79.83 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.235 1.414 . . . . 75.33 109.838 177.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.479 ' HB2' HE22 ' A' ' 27' ' ' GLN . . . -74.86 -24.34 58.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 CA-C-N 114.235 -1.348 . . . . 72.31 112.205 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -60.97 -45.76 93.46 Favored 'General case' 0 C--O 1.242 0.69 0 N-CA-C 108.861 -0.792 . . . . 44.24 108.861 168.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.405 ' HB2' ' O ' ' A' ' 140' ' ' ASP . 22.2 mm-40 -57.9 -54.16 50.08 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 115.182 -0.917 . . . . 75.04 111.291 175.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -62.09 -45.44 93.49 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 123.783 0.677 . . . . 72.54 112.5 -176.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -56.59 -54.3 47.53 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.768 0.827 . . . . 73.23 110.886 179.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 77.7 ttt-85 -71.9 -30.22 65.14 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.834 -0.621 . . . . 62.32 111.308 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.47 -25.4 59.37 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.089 0.556 . . . . 72.02 110.957 177.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -78.37 -57.8 3.59 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.263 0.625 . . . . 64.24 109.585 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . 0.443 ' NE2' HD23 ' A' ' 89' ' ' LEU . 25.5 mm-40 -62.72 -52.14 64.42 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.352 -0.84 . . . . 64.22 110.65 -175.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 96.0 mmm -100.62 79.33 2.08 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.542 -1.281 . . . . 65.51 107.542 171.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.411 HD21 ' O ' ' A' ' 155' ' ' ASN . 31.5 tp -82.92 113.69 20.7 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.375 -0.829 . . . . 72.22 109.65 -178.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.5 70.6 1.43 Allowed 'General case' 0 CA--C 1.551 1.001 0 CA-C-O 122.374 1.083 . . . . 65.42 108.937 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 51.8 ttt85 -159.74 60.26 0.37 Allowed 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 114.934 -1.03 . . . . 73.31 108.34 176.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 56.74 26.92 11.96 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 114.621 -1.172 . . . . 74.41 112.237 174.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.411 ' O ' HD21 ' A' ' 151' ' ' LEU . 52.6 m-80 68.9 -74.7 0.08 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 125.548 1.539 . . . . 71.41 111.418 -173.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 . . . . . 0 N--CA 1.475 0.812 0 CA-C-O 118.08 -0.962 . . . . 73.02 110.035 -178.108 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.407 ' HG3' ' HB2' ' A' ' 4' ' ' LEU . 11.5 ttm . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 121.233 0.54 . . . . 70.24 110.287 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -69.31 -32.6 71.82 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.536 0.735 . . . . 75.32 110.128 177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -70.44 -55.47 8.93 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 108.701 -0.851 . . . . 73.21 108.701 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.407 ' HB2' ' HG3' ' A' ' 1' ' ' MET . 32.1 mt -60.07 -32.21 70.73 Favored 'General case' 0 N--CA 1.475 0.782 0 O-C-N 124.145 0.903 . . . . 72.23 112.153 177.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -61.48 -53.37 57.28 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 109.398 -0.593 . . . . 64.31 109.398 176.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.9 m-70 -67.66 -36.45 80.75 Favored 'General case' 0 C--O 1.21 -0.974 0 O-C-N 123.828 0.705 . . . . 71.02 111.469 -178.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 68.0 mt -56.89 -54.14 33.58 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 123.813 0.845 . . . . 54.14 110.843 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 42.1 mm -67.21 -38.97 82.06 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 CA-C-N 115.085 -0.961 . . . . 70.23 110.94 -177.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.0 m -62.61 -47.39 83.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.279 0.632 . . . . 71.03 110.552 177.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.3 mt -58.11 -60.63 3.44 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.659 0.783 . . . . 63.51 110.09 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.78 -41.22 95.85 Favored Glycine 0 C--N 1.351 1.369 0 O-C-N 124.515 1.134 . . . . 41.24 113.898 -174.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.436 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 5.9 tp-100 -61.03 -56.15 24.36 Favored 'General case' 0 C--O 1.248 0.994 0 N-CA-C 109.649 -0.5 . . . . 73.54 109.649 178.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 85.3 t -62.98 -27.65 43.57 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.115 0 CA-C-N 115.263 -0.88 . . . . 75.13 111.393 179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.5 HD11 ' O ' ' A' ' 69' ' ' LEU . 27.7 mt -60.93 -54.14 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.085 0 C-N-CA 123.751 0.82 . . . . 64.44 109.618 176.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 52.0 t-80 -58.15 -39.97 80.17 Favored 'General case' 0 C--N 1.354 0.776 0 O-C-N 124.091 0.869 . . . . 74.11 110.508 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.436 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.4 mptm? -61.52 -51.43 68.65 Favored 'General case' 0 CA--C 1.554 1.106 0 O-C-N 123.826 0.704 . . . . 51.34 112.408 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 14.7 ptp180 -81.81 -15.71 53.27 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 112.411 0.523 . . . . 75.11 112.411 -176.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.619 ' SG ' HD23 ' A' ' 31' ' ' LEU . 45.4 t -69.69 -23.52 63.45 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.355 0.662 . . . . 71.24 110.829 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -65.17 -11.06 36.44 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 122.772 0.429 . . . . 72.51 112.127 177.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.89 -30.58 71.64 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.47 0.708 . . . . 54.45 111.849 173.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.2 mmt -67.91 89.42 0.28 Allowed 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.154 0.502 . . . . 65.44 111.401 -172.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.61 -20.26 61.32 Favored 'General case' 0 N--CA 1.484 1.229 0 CA-C-N 114.709 -1.132 . . . . 74.1 110.574 169.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.402 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.6 m-85 -121.19 147.82 45.09 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.362 1.065 . . . . 63.35 108.396 177.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.615 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 96.8 m 59.09 59.06 2.88 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 124.812 1.32 . . . . 75.14 110.337 -166.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.413 ' HG3' ' N ' ' A' ' 26' ' ' LYS . 44.1 pttt -70.29 -40.14 74.45 Favored 'General case' 0 CA--C 1.543 0.673 0 CA-C-N 114.174 -1.376 . . . . 72.14 111.782 -174.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.413 ' N ' ' HG3' ' A' ' 25' ' ' LYS . 60.1 tttm -78.02 -34.83 50.48 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.37 0.268 . . . . 73.15 110.305 -170.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -76.1 -25.48 55.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.339 0.656 . . . . 63.32 111.023 174.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.504 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 38.4 t -69.7 -44.27 70.73 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.743 0.817 . . . . 35.43 110.766 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -70.84 -33.3 70.52 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.635 0.774 . . . . 73.32 110.484 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 23.0 tpp180 -63.78 -44.33 93.71 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.56 0.744 . . . . 75.13 110.009 175.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.619 HD23 ' SG ' ' A' ' 18' ' ' CYS . 25.5 tp -59.1 -44.88 91.99 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 109.111 -0.699 . . . . 64.32 109.111 172.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.93 -47.53 88.32 Favored Glycine 0 C--N 1.353 1.486 0 O-C-N 124.148 0.905 . . . . 71.34 113.533 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 18.0 m-70 -66.2 -39.68 89.83 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.181 0.592 . . . . 71.34 111.268 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.57 HH12 ' HB2' ' A' ' 106' ' ' SER . 36.5 mtt180 -61.3 -62.01 2.14 Favored 'General case' 0 N--CA 1.476 0.828 0 O-C-N 123.408 0.443 . . . . 72.04 110.478 174.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 64.9 t -53.88 -41.82 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 124.627 1.171 . . . . 45.44 112.225 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.496 HD23 HD11 ' A' ' 39' ' ' ILE . 95.9 mt -68.64 -39.82 80.55 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 122.516 0.326 . . . . 73.42 110.611 176.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.07 -19.26 65.72 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-N 116.744 -0.207 . . . . 50.12 113.151 173.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 34' ' ' ARG . 5.2 mp -84.41 -53.53 5.39 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.452 1.101 . . . . 71.43 111.103 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.496 HD11 HD23 ' A' ' 36' ' ' LEU . 15.2 pt -83.69 -42.81 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 118.404 -0.808 . . . . 70.52 112.328 -168.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.413 ' O ' ' HG2' ' A' ' 44' ' ' MET . 55.1 mtmt -52.41 -53.23 55.48 Favored Pre-proline 0 N--CA 1.49 1.552 0 CA-C-O 118.116 -0.945 . . . . 73.04 112.853 -174.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.73 -43.22 51.85 Favored 'Trans proline' 0 C--N 1.398 3.146 0 C-N-CA 122.175 1.917 . . . . 74.44 111.7 178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -69.15 -29.08 67.03 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 115.322 -0.853 . . . . 70.51 112.081 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 51.1 mt-10 -76.0 -38.06 57.76 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.661 0.785 . . . . 71.34 110.474 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 26.4 mmt -62.63 -36.31 82.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 115.596 -0.729 . . . . 74.5 110.111 177.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.3 mt -80.6 -33.73 35.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.719 0.808 . . . . 70.3 111.042 176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -66.02 -32.93 74.7 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.563 1.145 . . . . 75.03 111.223 -178.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -58.61 -42.13 87.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 124.046 0.842 . . . . 74.33 110.886 -179.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.17 -43.98 69.7 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.619 -0.719 . . . . 55.24 109.721 171.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.47 -71.1 2.87 Favored Glycine 0 C--N 1.348 1.219 0 N-CA-C 111.065 -0.814 . . . . 51.4 111.065 -176.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? 69.94 141.53 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.696 1.598 . . . . 71.01 112.124 175.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.55 86.4 0.64 Allowed 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.82 -0.807 . . . . 73.31 108.82 174.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 12.7 m -114.84 129.17 56.65 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 114.286 -1.325 . . . . 71.1 107.776 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 51.7 t -81.73 112.67 36.5 Favored Pre-proline 0 CA--C 1.542 0.654 0 N-CA-C 108.721 -0.844 . . . . 45.44 108.721 177.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -72.24 94.18 0.74 Allowed 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 122.568 2.178 . . . . 74.32 110.497 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 43.5 t -56.72 151.57 13.85 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.538 -0.756 . . . . 71.44 109.605 175.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -59.51 -39.47 83.95 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.083 0.553 . . . . 54.52 111.681 -174.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -71.41 -36.03 71.2 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.673 0.789 . . . . 74.21 111.807 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.54 -46.07 87.67 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.211 -1.033 . . . . 64.14 108.211 178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 46.5 m -69.28 -40.27 77.84 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 114.348 -1.296 . . . . 74.44 110.873 -178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 97.6 m -60.32 -43.15 96.65 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.268 0.627 . . . . 70.23 110.811 177.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.64 88.97 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 123.778 0.673 . . . . 54.42 109.998 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.459 ' SD ' HD11 ' A' ' 112' ' ' LEU . 26.3 mmt -64.27 -25.07 67.89 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.266 -0.879 . . . . 74.23 112.362 176.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -77.54 -44.13 29.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.287 0.635 . . . . 73.31 110.693 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -59.18 -45.09 91.94 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.875 0.734 . . . . 74.45 109.401 175.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -61.18 -50.76 71.84 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 113.245 -1.798 . . . . 63.35 110.746 -178.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -58.56 -48.65 80.22 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.939 1.296 . . . . 75.14 110.624 178.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.28 -39.39 93.84 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.351 0.661 . . . . 74.2 111.743 -177.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -69.72 -34.3 73.69 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.707 -0.679 . . . . 72.22 110.911 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.5 ' O ' HD11 ' A' ' 14' ' ' ILE . 89.8 mt -69.48 -34.09 73.84 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 122.732 0.413 . . . . 72.03 110.74 174.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -63.77 -40.57 97.0 Favored 'General case' 0 N--CA 1.486 1.325 0 CA-C-O 120.834 0.35 . . . . 74.51 110.751 173.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.88 -39.97 87.67 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 115.67 -0.695 . . . . 65.21 111.175 178.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.26 -39.32 89.39 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.258 0.623 . . . . 75.42 110.998 178.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 43.1 t-20 -62.43 -44.56 96.13 Favored 'General case' 0 C--N 1.351 0.65 0 O-C-N 124.565 1.166 . . . . 73.52 109.38 177.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.6 -36.8 93.82 Favored Glycine 0 C--N 1.347 1.192 0 CA-C-N 115.781 -0.645 . . . . 72.52 112.957 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -60.34 -52.93 63.17 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.69 0.396 . . . . 74.01 110.884 177.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.409 HG23 ' CE2' ' A' ' 98' ' ' PHE . 0.3 OUTLIER -66.75 -26.48 37.28 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 112.73 0.641 . . . . 73.42 112.73 178.639 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -63.35 -36.02 82.32 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.087 0.47 . . . . 63.52 111.163 170.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.8 ttpt -76.74 -38.56 54.0 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.733 0.813 . . . . 73.13 111.024 175.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -80.18 -0.86 37.92 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.871 0.868 . . . . 73.23 113.033 -173.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 68.6 p -58.2 -29.28 65.55 Favored 'General case' 0 N--CA 1.48 1.071 0 CA-C-O 121.054 0.454 . . . . 33.31 110.608 169.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -82.29 110.35 17.38 Favored 'General case' 0 C--N 1.348 0.541 0 CA-C-N 115.086 -0.961 . . . . 51.13 108.76 169.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -69.85 -31.73 69.73 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.775 0.83 . . . . 75.54 111.122 -174.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.0 p -67.73 -37.85 82.74 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.151 0.98 . . . . 52.12 111.18 176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -61.76 -38.48 88.17 Favored 'General case' 0 C--O 1.25 1.114 0 C-N-CA 123.456 0.702 . . . . 75.25 111.05 -179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.496 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 22.6 mt -59.84 -49.7 82.88 Favored 'Isoleucine or valine' 0 C--N 1.353 0.749 0 CA-C-N 115.529 -0.759 . . . . 64.3 109.724 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.8 t -62.15 -35.06 77.63 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.222 0.609 . . . . 64.43 111.562 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 tpt180 -64.33 -47.72 78.31 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 124.055 0.847 . . . . 72.35 111.268 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -75.77 -32.44 59.94 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 110.002 -0.369 . . . . 71.44 110.002 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 9.7 tp -61.96 -50.62 71.39 Favored 'General case' 0 C--N 1.359 0.994 0 C-N-CA 124.184 0.994 . . . . 73.04 110.033 -174.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -61.23 -29.01 69.57 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-N 115.932 -0.576 . . . . 75.14 112.25 -178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.2 -54.48 6.44 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.355 0.662 . . . . 60.22 111.356 -177.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -99.07 115.14 28.31 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.61 0.764 . . . . 74.44 109.622 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.476 ' HA ' ' CZ ' ' A' ' 145' ' ' ARG . 50.2 mt-30 -80.06 -46.48 16.46 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 112.88 0.696 . . . . 54.52 112.88 -170.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.17 -23.28 35.62 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.164 0.586 . . . . 71.41 111.098 -176.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -62.16 114.73 3.6 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 124.313 1.008 . . . . 73.32 110.841 -169.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.496 HG13 ' HB2' ' A' ' 141' ' ' ALA . 3.0 mp -61.71 157.39 3.38 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.024 0 CA-C-N 114.311 -1.313 . . . . 75.12 107.551 171.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -55.8 -31.4 62.61 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.855 0.862 . . . . 61.34 112.049 -173.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.415 ' CZ ' HD22 ' A' ' 31' ' ' LEU . 91.2 m-85 -125.57 25.54 6.97 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.107 -0.949 . . . . 71.11 110.694 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? -36.28 -64.02 0.35 Allowed 'General case' 0 N--CA 1.506 2.343 0 C-N-CA 125.488 1.515 . . . . 63.13 113.607 -163.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -67.31 -48.87 66.32 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.129 0.972 . . . . 73.52 111.553 -170.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.06 -43.38 88.9 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 CA-C-N 114.765 -1.107 . . . . 65.44 110.875 -177.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.519 ' HA ' ' HB2' ' A' ' 105' ' ' LEU . 67.3 t30 -78.34 -18.32 55.32 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.986 1.315 . . . . 73.35 110.212 -176.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.9 tmm_? -71.05 -39.78 72.07 Favored 'General case' 0 C--N 1.352 0.691 0 N-CA-C 107.746 -1.205 . . . . 61.43 107.746 168.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -64.73 -39.69 94.07 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.516 0.51 . . . . 72.41 110.523 170.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.519 ' HB2' ' HA ' ' A' ' 102' ' ' ASN . 9.4 mp -60.07 -43.92 95.11 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 109.766 -0.457 . . . . 73.33 109.766 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.57 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.4 t -66.04 -47.5 74.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.116 0.566 . . . . 70.13 110.789 -178.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -66.35 -57.35 7.65 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.642 1.177 . . . . 75.2 110.966 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 98.8 t -63.52 -39.85 86.87 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.44 0 CA-C-N 115.566 -0.743 . . . . 72.04 111.258 -177.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.447 ' HE1' ' HG2' ' A' ' 126' ' ' PRO . 55.2 t-105 -69.37 -39.05 78.29 Favored 'General case' 0 C--N 1.351 0.633 0 CA-C-O 118.543 -0.741 . . . . 73.41 111.88 -178.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.72 -38.47 83.63 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 119.4 1.0 . . . . 72.42 110.534 175.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -60.5 -46.58 89.58 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.03 0.532 . . . . 73.25 110.903 174.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.477 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 8.4 tt -70.39 -48.2 57.32 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.595 1.158 . . . . 73.41 109.936 -172.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 88.1 p -65.63 -43.1 90.54 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.724 0.81 . . . . 73.0 110.891 -177.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.7 mt -68.87 -35.33 76.77 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 119.234 -0.413 . . . . 72.42 112.041 179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.0 pp -74.67 -21.78 59.23 Favored 'General case' 0 N--CA 1.487 1.38 0 CA-C-N 118.705 0.684 . . . . 75.43 110.896 175.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.0 mt -70.93 -35.33 72.18 Favored 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 109.916 -0.401 . . . . 65.24 109.916 167.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.55 -29.81 65.17 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.73 0.812 . . . . 53.24 111.662 176.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 114' ' ' LEU . 89.3 t -85.2 -62.13 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 122.728 0.411 . . . . 65.02 110.957 179.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -75.93 -56.14 4.95 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.203 0.601 . . . . 73.15 111.687 -170.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -85.12 -18.24 34.83 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.177 0.591 . . . . 74.12 110.808 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 46.2 mtm180 61.52 16.22 7.41 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 125.63 1.572 . . . . 74.55 112.798 -177.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 36.6 mtm -71.84 140.83 83.94 Favored Pre-proline 0 N--CA 1.47 0.553 0 N-CA-C 109.522 -0.547 . . . . 73.32 109.522 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -81.0 35.65 0.59 Allowed 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 123.499 2.799 . . . . 51.42 112.813 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.9 t -91.08 93.06 4.16 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.397 -0.964 . . . . 74.23 108.397 176.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 23.0 t -158.65 77.37 3.27 Favored Pre-proline 0 CA--C 1.548 0.893 0 C-N-CA 123.304 0.641 . . . . 64.1 110.037 171.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.447 ' HG2' ' HE1' ' A' ' 109' ' ' TRP . 62.0 Cg_endo -85.36 38.42 0.64 Allowed 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 123.503 2.802 . . . . 71.05 112.086 173.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.406 HD12 ' CE3' ' A' ' 133' ' ' TRP . 12.7 tt -159.11 -50.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-N 115.827 -0.624 . . . . 70.41 110.604 -174.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 66.2 m 46.49 -84.98 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.657 1.583 . . . . 73.55 113.474 -174.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.686 HE21 ' HB3' ' A' ' 131' ' ' ALA . 17.3 pt20 -72.16 -40.91 67.66 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.347 0.659 . . . . 54.41 111.353 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 81.0 -7.88 58.67 Favored Glycine 0 C--N 1.349 1.254 0 CA-C-O 119.754 -0.47 . . . . 55.31 114.013 -176.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.686 ' HB3' HE21 ' A' ' 129' ' ' GLN . . . -64.39 -37.85 88.95 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 123.674 0.79 . . . . 64.21 110.868 177.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.436 ' O ' ' HG3' ' A' ' 136' ' ' GLU . 33.9 p -57.54 -55.62 32.53 Favored 'General case' 0 C--N 1.35 0.628 0 O-C-N 124.293 0.995 . . . . 72.34 110.25 173.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.406 ' CE3' HD12 ' A' ' 127' ' ' ILE . 5.9 m0 -53.96 -41.96 68.4 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.568 1.147 . . . . 74.3 113.077 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.44 -37.11 82.48 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 122.785 0.434 . . . . 44.34 111.877 -178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -74.58 -43.58 54.95 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.904 0.482 . . . . 74.14 111.269 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 132' ' ' SER . 44.7 mt-10 -63.07 -53.71 49.46 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.502 0.721 . . . . 61.4 110.976 -174.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -59.83 -29.73 68.46 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.541 0.737 . . . . 74.21 112.461 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -71.52 -45.25 62.9 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 123.757 0.661 . . . . 74.03 110.729 178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -68.27 -35.75 78.37 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-N 116.026 -0.533 . . . . 73.31 110.548 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.47 -45.0 81.17 Favored 'General case' 0 N--CA 1.474 0.762 0 CA-C-N 115.39 -0.823 . . . . 74.31 109.043 176.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.496 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -57.69 -40.89 80.47 Favored 'General case' 0 C--N 1.353 0.728 0 O-C-N 124.272 0.982 . . . . 62.24 111.181 178.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.77 -60.6 3.27 Favored 'General case' 0 CA--C 1.548 0.902 0 O-C-N 124.084 0.865 . . . . 72.43 110.903 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.76 -46.73 86.8 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.261 1.024 . . . . 74.24 111.689 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -78.58 -27.22 45.64 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.185 -1.371 . . . . 64.42 110.84 -170.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.476 ' CZ ' ' HA ' ' A' ' 93' ' ' GLN . 57.0 ttt85 -61.68 -47.8 83.68 Favored 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 115.939 -0.573 . . . . 73.4 109.681 167.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -62.84 -37.3 86.27 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 123.766 0.666 . . . . 54.15 110.688 176.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.45 -20.91 62.86 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.779 0.675 . . . . 75.1 111.684 178.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.615 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -84.85 -62.45 1.54 Allowed 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 117.804 0.275 . . . . 73.5 110.552 172.225 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 28.4 mm-40 -68.26 -24.3 64.87 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.432 1.093 . . . . 64.43 111.485 -166.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 44.0 ttm -139.57 83.22 1.92 Allowed 'General case' 0 C--O 1.24 0.554 0 N-CA-C 107.378 -1.342 . . . . 65.31 107.378 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 1.3 tt -70.57 82.94 0.6 Allowed 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.614 -0.721 . . . . 75.02 109.303 -172.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -158.43 83.71 0.84 Allowed 'General case' 0 C--O 1.238 0.467 0 N-CA-C 107.771 -1.196 . . . . 75.32 107.771 -177.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 11.1 tpt180 -170.64 -46.53 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 107.415 -1.328 . . . . 55.13 107.415 -172.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -165.19 136.58 4.06 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 113.689 -1.596 . . . . 70.42 108.427 174.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -145.02 173.12 12.16 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.711 0.804 . . . . 74.03 109.909 178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 . . . . . 0 CA--C 1.549 0.942 0 C-N-CA 123.822 0.849 . . . . 65.25 109.827 -176.74 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.2 ttp . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 110.622 -0.14 . . . . 72.45 110.622 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -58.47 -22.28 54.2 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.43 0.692 . . . . 63.11 111.559 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -54.19 -57.35 11.49 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.604 1.162 . . . . 64.44 108.776 171.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.94 -44.25 97.15 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 114.961 -1.018 . . . . 72.51 110.5 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -58.31 -51.19 70.84 Favored 'General case' 0 N--CA 1.472 0.628 0 O-C-N 123.571 0.545 . . . . 73.43 111.07 -175.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 22.0 m-70 -67.9 -52.1 40.32 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.032 0.533 . . . . 72.31 111.182 -178.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 76.8 mt -53.61 -50.21 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 124.12 0.968 . . . . 74.52 111.86 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.455 ' O ' ' HG2' ' A' ' 12' ' ' GLN . 99.6 mt -63.68 -46.44 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 118.545 -0.74 . . . . 74.32 109.667 179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -51.63 -44.17 62.84 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 123.754 0.659 . . . . 52.21 110.571 176.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 84.6 mt -59.85 -50.9 71.99 Favored 'General case' 0 N--CA 1.47 0.535 0 O-C-N 123.729 0.643 . . . . 74.3 110.307 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.78 -33.82 87.0 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 124.385 1.053 . . . . 62.21 113.629 -177.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.473 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 19.3 mm-40 -64.9 -52.79 54.59 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.668 -0.864 . . . . 71.54 108.668 176.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 76.4 t -59.71 -34.63 56.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 124.354 1.062 . . . . 53.44 110.946 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 40.0 mt -58.71 -51.6 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 123.983 0.913 . . . . 74.24 109.736 174.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.5 t-80 -64.06 -36.4 83.88 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.815 0.697 . . . . 73.54 110.346 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.1 mmmt -79.65 -29.05 40.84 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.352 0.661 . . . . 65.34 112.653 -173.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.407 ' O ' ' HG2' ' A' ' 20' ' ' GLU . 11.6 ptm180 -87.98 -20.97 25.14 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 122.219 -0.301 . . . . 71.24 110.756 174.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 36.5 t -74.05 -20.26 60.36 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.781 0.832 . . . . 51.22 110.927 175.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -48.85 -36.43 16.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.832 0.853 . . . . 75.4 112.402 178.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.451 ' HB2' ' NH2' ' A' ' 82' ' ' ARG . 12.8 pt-20 -76.83 -3.37 38.1 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.464 0.913 . . . . 75.13 113.464 -170.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 18.6 mmt -74.98 83.91 2.25 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 109.64 -0.504 . . . . 63.22 109.64 178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 28.4 ttpt -70.1 -36.45 74.88 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.929 -0.767 . . . . 73.33 108.929 174.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 90.8 m-85 -95.86 158.26 15.53 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 114.743 -1.117 . . . . 73.34 109.215 168.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.677 ' SG ' HG21 ' A' ' 85' ' ' ILE . 91.8 m 56.51 58.96 3.84 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 124.237 0.961 . . . . 74.44 109.934 -169.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -70.53 -49.4 48.56 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 113.675 -1.602 . . . . 72.22 110.379 -171.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 52.4 mttm -70.58 -38.93 74.14 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.027 -0.988 . . . . 73.13 110.995 -174.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -72.27 -26.34 61.95 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.29 0.636 . . . . 74.11 111.337 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 49.7 t -69.46 -37.48 77.33 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.42 0.688 . . . . 74.54 110.311 170.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -71.89 -34.23 68.98 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 115.548 -0.751 . . . . 74.52 110.573 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 26' ' ' LYS . 29.0 mmt180 -69.2 -60.58 2.25 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.913 0.485 . . . . 73.2 109.985 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 22.7 tp -54.79 -49.35 71.16 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.857 0.723 . . . . 75.1 110.146 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.11 -55.48 30.09 Favored Glycine 0 C--N 1.347 1.161 0 O-C-N 124.059 0.849 . . . . 74.3 113.548 -176.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 -67.94 -36.83 80.81 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.882 0.873 . . . . 74.43 110.996 -175.069 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.504 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 42.3 mtt-85 -63.42 -62.41 1.7 Allowed 'General case' 0 N--CA 1.475 0.79 0 O-C-N 123.822 0.701 . . . . 74.3 110.704 176.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 87.1 t -54.06 -46.76 66.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 C-N-CA 124.041 0.936 . . . . 73.31 110.989 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 13.7 tp -64.92 -38.43 90.96 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.228 -0.896 . . . . 54.54 109.708 -179.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -75.71 -13.24 83.21 Favored Glycine 0 CA--C 1.536 1.354 0 CA-C-N 115.539 -0.755 . . . . 71.45 113.738 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 65.6 mt -84.09 -44.93 13.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.137 0.575 . . . . 75.24 110.003 174.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 7.5 pt -85.97 -24.43 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 CA-C-N 115.498 -0.774 . . . . 71.4 112.407 -172.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -62.05 -47.28 91.1 Favored Pre-proline 0 N--CA 1.497 1.899 0 N-CA-C 112.899 0.703 . . . . 73.12 112.899 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -52.65 -51.48 11.02 Favored 'Trans proline' 0 C--N 1.403 3.429 0 C-N-CA 121.758 1.639 . . . . 60.11 110.447 171.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -68.07 -19.61 64.89 Favored 'General case' 0 C--O 1.215 -0.728 0 CA-C-N 115.296 -0.866 . . . . 52.24 111.772 -177.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -68.1 -55.34 12.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.351 0.66 . . . . 63.2 110.013 174.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 50.7 mtm -64.65 -35.31 80.62 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 114.908 -1.042 . . . . 73.32 110.166 -179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' SD ' ' A' ' 122' ' ' MET . 68.3 mt -82.02 -18.92 41.63 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.76 1.224 . . . . 74.32 111.838 -179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -75.43 -43.1 51.53 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 109.454 -0.572 . . . . 72.32 109.454 172.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -55.51 -45.28 77.11 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.788 -1.096 . . . . 65.42 110.231 177.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -78.26 -37.95 43.89 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.838 -1.074 . . . . 73.43 110.809 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.6 52.93 4.52 Favored Glycine 0 C--N 1.344 1.007 0 CA-C-N 115.58 -0.736 . . . . 74.33 112.4 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -69.33 108.96 3.91 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.06 0.944 . . . . 73.22 110.264 -179.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.6 mtm180 70.87 24.67 4.06 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 125.654 1.582 . . . . 74.22 112.009 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 70.7 m -61.4 129.56 41.81 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 122.658 0.383 . . . . 74.42 110.632 177.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 44.6 t -84.63 113.24 47.99 Favored Pre-proline 0 CA--C 1.55 0.971 0 O-C-N 124.241 0.963 . . . . 75.01 110.215 -177.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -82.22 151.0 15.69 Favored 'Trans proline' 0 C--N 1.373 1.863 0 C-N-CA 123.189 2.592 . . . . 74.33 111.344 174.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.2 p -77.05 -179.73 5.74 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.979 0.512 . . . . 73.24 110.495 175.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.14 -34.48 68.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.193 0.597 . . . . 71.33 110.136 175.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.7 mtpp -59.35 -51.49 69.7 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.819 0.848 . . . . 72.4 110.27 170.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.576 HD22 HD13 ' A' ' 115' ' ' LEU . 0.7 OUTLIER -54.96 -46.36 75.02 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 114.427 -1.26 . . . . 64.52 110.26 176.739 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 94.2 m -58.68 -46.83 86.37 Favored 'General case' 0 C--N 1.356 0.863 0 C-N-CA 124.025 0.93 . . . . 73.14 110.537 -178.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.1 m -61.88 -50.26 72.95 Favored 'General case' 0 C--N 1.354 0.791 0 O-C-N 123.982 0.801 . . . . 71.12 110.352 -178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 64' ' ' ARG . . . -59.78 -40.47 88.35 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.949 0.899 . . . . 52.11 111.407 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.436 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.4 mmt -66.58 -35.59 80.59 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 115.481 -0.781 . . . . 75.11 110.842 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -71.7 -35.66 70.31 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.278 0.631 . . . . 62.22 111.039 178.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 61' ' ' ALA . 66.8 mtp85 -68.38 -41.13 81.03 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.072 0.949 . . . . 73.41 110.086 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.409 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 7.6 t80 -71.93 -41.2 68.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.64 -1.163 . . . . 73.25 110.023 -177.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 1.2 tmtp? -59.78 -48.35 82.02 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 125.092 1.357 . . . . 72.4 109.066 175.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.529 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -61.52 -40.66 95.44 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 124.538 1.149 . . . . 54.5 110.909 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.646 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -64.37 -36.1 83.04 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.698 0.799 . . . . 64.32 110.747 178.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -73.06 -27.69 61.88 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.282 0.633 . . . . 64.51 111.57 175.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 13.1 mm-40 -64.72 -41.55 95.89 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.338 -0.616 . . . . 75.54 109.338 172.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.529 ' HG2' ' O ' ' A' ' 67' ' ' ALA . 5.0 mm-40 -59.48 -49.01 79.46 Favored 'General case' 0 C--N 1.358 0.95 0 CA-C-N 115.119 -0.946 . . . . 73.3 110.333 177.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.52 -47.48 85.38 Favored 'General case' 0 N--CA 1.479 0.996 0 O-C-N 123.957 0.786 . . . . 71.51 111.572 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.88 -48.75 80.3 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 124.4 1.063 . . . . 53.22 111.174 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.41 ' O ' ' HG2' ' A' ' 78' ' ' LYS . . . -61.35 -38.74 96.21 Favored Glycine 0 C--N 1.351 1.378 0 O-C-N 124.026 0.829 . . . . 31.41 112.815 179.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -62.89 -56.78 14.25 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-O 118.765 -0.636 . . . . 70.14 111.135 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.566 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 0.8 OUTLIER -63.49 -23.06 32.35 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 122.756 0.423 . . . . 75.23 112.053 177.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.47 -38.05 80.71 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 122.675 0.39 . . . . 63.32 110.262 175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 74' ' ' GLY . 31.5 mmtp -83.9 -29.5 27.13 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.453 0.301 . . . . 70.44 111.129 176.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.566 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.8 m-85 -77.46 -8.52 57.88 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 124.319 1.048 . . . . 62.13 111.335 179.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.1 p -56.37 -30.41 62.64 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.214 0.606 . . . . 74.24 109.889 171.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -81.21 102.13 10.14 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 107.54 -1.281 . . . . 71.33 107.54 165.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.616 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.6 mpt_? -70.32 -24.89 63.09 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.749 0.82 . . . . 63.43 110.535 -175.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 72.4 p -66.89 -40.98 87.93 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.947 0.899 . . . . 44.33 110.478 172.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 -57.86 -42.29 84.2 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.011 0.924 . . . . 74.12 110.65 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.677 HG21 ' SG ' ' A' ' 24' ' ' CYS . 15.7 mt -58.81 -57.45 11.16 Favored 'Isoleucine or valine' 0 C--N 1.356 0.889 0 CA-C-N 115.323 -0.853 . . . . 75.24 109.379 177.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.4 t -53.77 -37.09 63.08 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.766 0.827 . . . . 53.44 112.146 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 53.7 tpt85 -60.67 -45.71 93.08 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.832 1.253 . . . . 75.1 111.277 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.95 -25.95 29.65 Favored 'General case' 0 N--CA 1.489 1.511 0 CA-C-O 120.408 0.147 . . . . 70.11 110.78 176.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.464 ' HG ' ' HG3' ' A' ' 145' ' ' ARG . 13.4 tp -78.01 -29.21 49.42 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.572 0.749 . . . . 71.11 111.635 -167.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -72.76 -26.62 61.61 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.114 0.566 . . . . 71.41 110.214 178.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -85.13 -37.27 20.42 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.018 0.927 . . . . 74.14 110.369 178.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.581 ' HB2' ' HB2' ' A' ' 95' ' ' LYS . 79.2 p -79.13 133.73 36.73 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.108 0.563 . . . . 63.23 110.384 -178.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -94.97 -43.08 8.32 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.759 0.824 . . . . 64.51 110.853 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -146.7 11.19 1.09 Allowed 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.51 0.724 . . . . 61.11 110.96 -178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.581 ' HB2' ' HB2' ' A' ' 92' ' ' SER . 99.4 mttt -67.16 89.03 0.18 Allowed 'General case' 0 C--N 1.354 0.761 0 N-CA-C 108.104 -1.073 . . . . 65.41 108.104 169.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 16.3 mm -57.28 137.87 18.82 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 N-CA-C 107.923 -1.139 . . . . 64.1 107.923 177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.3 mp -45.33 -38.52 5.84 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 124.198 0.999 . . . . 63.21 112.488 -177.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.44 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 61.4 m-85 -125.65 39.31 3.99 Favored 'General case' 0 C--O 1.204 -1.326 0 C-N-CA 123.924 0.89 . . . . 65.52 109.797 -177.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 95' ' ' LYS . 21.9 pttp -56.55 -58.47 7.91 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.755 0.707 . . . . 74.04 111.399 -176.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.32 -47.89 53.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.523 1.129 . . . . 72.11 110.229 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 81.0 t -54.71 -63.53 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.35 0.605 0 O-C-N 124.372 1.045 . . . . 71.15 110.933 -177.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.426 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 43.6 t30 -65.9 -28.03 68.64 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.774 1.23 . . . . 74.11 111.475 -176.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 34.8 ttt180 -57.66 -46.87 83.68 Favored 'General case' 0 C--N 1.365 1.254 0 N-CA-C 110.02 -0.363 . . . . 74.41 110.02 169.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 46.6 mtmt -67.36 -32.55 73.56 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.189 0.596 . . . . 75.41 111.944 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.646 HD12 ' HB1' ' A' ' 68' ' ' ALA . 11.0 mp -60.7 -47.92 84.09 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 110.012 -0.366 . . . . 72.41 110.012 171.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 21.7 m -68.46 -39.67 81.34 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.048 0.939 . . . . 44.04 111.323 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.536 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 9.5 t0 -68.0 -58.41 4.57 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.468 -1.242 . . . . 65.44 109.151 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.5 t -65.15 -33.93 67.1 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 CA-C-N 115.449 -0.796 . . . . 73.12 110.348 -178.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 49.3 t-105 -60.62 -44.09 96.73 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 119.187 -0.435 . . . . 74.53 111.479 176.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 19.1 pttm -64.61 -43.85 92.46 Favored 'General case' 0 CA--C 1.552 1.03 0 N-CA-C 108.987 -0.745 . . . . 72.02 108.987 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.7 mt-10 -61.05 -42.57 98.73 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.696 0.799 . . . . 72.12 110.747 178.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.436 HD11 ' SD ' ' A' ' 62' ' ' MET . 7.0 tt -71.41 -48.47 49.56 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.966 1.306 . . . . 62.3 109.785 -171.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 39.3 t -61.0 -34.66 75.16 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 124.418 1.087 . . . . 74.21 110.922 176.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 57.4 mt -63.9 -58.47 6.68 Favored 'General case' 0 C--N 1.36 1.036 0 C-N-CA 123.043 0.537 . . . . 75.4 111.502 175.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.576 HD13 HD22 ' A' ' 58' ' ' LEU . 2.0 pp -67.31 -20.26 65.58 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-N 118.569 0.622 . . . . 63.24 112.164 -179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.635 HD13 ' SD ' ' A' ' 122' ' ' MET . 46.7 mt -64.01 -55.27 23.54 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.747 0.419 . . . . 72.55 110.635 167.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -71.22 -26.49 62.96 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.052 0.389 . . . . 74.3 112.052 -175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 79.3 t -78.42 -54.33 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 123.418 0.687 . . . . 75.43 110.517 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -90.15 -59.14 2.27 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 112.075 0.398 . . . . 73.23 112.075 -172.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -77.25 -14.44 59.76 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 122.721 0.408 . . . . 74.3 110.944 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.14 54.69 6.61 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.904 1.281 . . . . 63.4 108.858 -175.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.635 ' SD ' HD13 ' A' ' 116' ' ' LEU . 51.0 ttm -92.24 131.0 35.85 Favored Pre-proline 0 CA--C 1.54 0.574 0 N-CA-C 108.414 -0.958 . . . . 71.3 108.414 174.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 2.7 Cg_exo -76.52 22.78 0.51 Allowed 'Trans proline' 0 C--N 1.371 1.753 0 C-N-CA 122.958 2.438 . . . . 74.41 113.61 -178.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 13.9 p -76.04 109.5 9.91 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.078 0 C-N-CA 123.541 0.736 . . . . 64.21 110.598 -175.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 66.7 m -151.46 76.07 7.71 Favored Pre-proline 0 CA--C 1.54 0.577 0 N-CA-C 107.702 -1.222 . . . . 72.04 107.702 166.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -82.52 -16.49 8.01 Favored 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 122.354 2.036 . . . . 71.13 111.714 175.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 11.4 tt -126.97 144.94 35.51 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.626 1.17 . . . . 44.25 109.329 -175.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 39.1 p -76.32 -61.91 1.79 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.57 0.748 . . . . 75.24 110.259 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -159.4 -12.26 0.06 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.352 0.661 . . . . 74.44 112.276 -176.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.436 ' HA2' ' HB2' ' A' ' 133' ' ' TRP . . . 95.52 16.22 40.67 Favored Glycine 0 C--N 1.35 1.329 0 CA-C-O 120.023 -0.32 . . . . 53.32 112.951 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -65.47 -52.06 55.7 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.791 0.837 . . . . 61.13 110.835 -179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 50.2 m -73.55 -30.86 63.32 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.242 -0.89 . . . . 62.44 110.787 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.436 ' HB2' ' HA2' ' A' ' 130' ' ' GLY . 0.1 OUTLIER -60.01 -43.61 95.1 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.185 0.994 . . . . 73.33 111.7 -179.175 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.11 -41.38 92.48 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.499 0.719 . . . . 72.33 111.216 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.457 ' HA ' HE21 ' A' ' 135' ' ' GLN . 0.0 OUTLIER -72.03 -45.14 61.98 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.897 0.879 . . . . 71.5 111.464 -178.581 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.441 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 19.0 mm-40 -50.1 -55.95 12.85 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.656 1.182 . . . . 64.12 111.449 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.99 -52.18 45.84 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 114.467 -1.242 . . . . 72.44 111.979 -174.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.74 -40.08 91.06 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 118.247 0.476 . . . . 74.42 111.289 -174.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -53.16 19.67 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.409 0.684 . . . . 74.25 109.237 -177.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -66.89 -34.87 78.73 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.911 -1.04 . . . . 63.21 110.234 -175.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -72.03 -31.93 66.64 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.103 0.961 . . . . 64.42 111.215 179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -65.06 -47.26 77.97 Favored 'General case' 0 C--O 1.243 0.721 0 O-C-N 123.738 0.649 . . . . 65.02 110.327 174.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -62.36 -33.8 75.43 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.768 -0.651 . . . . 71.12 111.593 174.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.7 t0 -72.58 -41.96 65.1 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.231 1.012 . . . . 71.24 111.521 -178.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.464 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 26.8 ttp85 -60.76 -43.23 98.27 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 114.855 -1.066 . . . . 74.41 109.128 176.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 13.7 ttp-105 -66.71 -33.92 76.7 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 114.972 -1.013 . . . . 74.41 111.548 175.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -68.4 -27.61 66.37 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.452 0.301 . . . . 53.43 111.101 177.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -84.26 -47.64 10.57 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.198 0.599 . . . . 75.32 110.653 177.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -80.99 -41.63 22.44 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.67 0.788 . . . . 74.02 112.43 -168.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 49.1 ttm -76.73 -61.0 2.11 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.515 -1.291 . . . . 74.34 107.515 171.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.462 ' HG ' ' H ' ' A' ' 153' ' ' ARG . 18.5 tp 65.01 163.66 0.15 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.705 1.202 . . . . 75.24 112.207 175.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 21.0 ttm-85 -160.64 33.88 0.16 Allowed 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.852 0.834 . . . . 73.12 109.24 175.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.462 ' H ' ' HG ' ' A' ' 151' ' ' LEU . 1.5 tpm_? -122.28 174.52 6.94 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.468 1.107 . . . . 74.34 109.123 -176.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -53.56 126.02 20.2 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.825 0.85 . . . . 74.31 111.866 -177.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.422 HD22 ' N ' ' A' ' 155' ' ' ASN . 0.0 OUTLIER -156.81 -166.27 2.06 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 124.182 0.993 . . . . 75.53 109.261 -170.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 . . . . . 0 CA--C 1.562 1.417 0 C-N-CA 123.289 0.636 . . . . 70.21 111.116 -179.843 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.551 ' HG3' ' H ' ' A' ' 2' ' ' GLU . 12.6 ptm . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 110.745 -0.095 . . . . 74.22 110.745 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.551 ' H ' ' HG3' ' A' ' 1' ' ' MET . 3.5 tm-20 -80.08 -48.06 13.84 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 108.2 -1.037 . . . . 75.01 108.2 -176.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.549 ' HA ' ' HD2' ' A' ' 66' ' ' LYS . 5.1 p30 -55.76 -43.99 77.21 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 114.471 -1.24 . . . . 61.52 111.14 170.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.455 ' O ' HG12 ' A' ' 8' ' ' ILE . 29.2 mt -65.55 -33.44 75.92 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.529 0.731 . . . . 72.41 111.789 175.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.6 tmtp? -60.7 -44.92 95.97 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 107.973 -1.121 . . . . 75.24 107.973 177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -68.72 -40.14 80.08 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.858 -0.61 . . . . 74.1 111.915 177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.45 HD12 HD23 ' A' ' 4' ' ' LEU . 83.9 mt -58.9 -53.14 51.77 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.394 0.678 . . . . 51.33 110.612 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.756 HG23 ' HG2' ' A' ' 43' ' ' GLU . 30.6 mm -70.29 -53.68 22.0 Favored 'Isoleucine or valine' 0 C--O 1.245 0.852 0 CA-C-N 115.413 -0.812 . . . . 71.04 110.806 -174.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 92.1 m -60.41 -58.96 6.27 Favored 'General case' 0 C--N 1.352 0.695 0 O-C-N 123.834 0.709 . . . . 72.32 110.848 -177.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.422 ' O ' HG13 ' A' ' 14' ' ' ILE . 95.0 mt -66.48 -32.41 73.76 Favored 'General case' 0 C--O 1.212 -0.916 0 CA-C-O 118.644 -0.693 . . . . 73.5 111.748 -175.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -63.09 -43.01 99.39 Favored Glycine 0 C--N 1.349 1.272 0 C-N-CA 121.387 -0.435 . . . . 65.31 112.473 174.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.6 tp-100 -69.02 -38.77 79.39 Favored 'General case' 0 CA--C 1.552 1.026 0 O-C-N 122.427 -0.455 . . . . 72.04 110.647 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.5 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 73.0 t -64.32 -34.85 71.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.554 0.742 . . . . 72.01 110.386 175.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.472 HG21 HG21 ' A' ' 35' ' ' VAL . 54.8 mt -56.85 -52.81 50.31 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.669 0.787 . . . . 71.32 109.152 172.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -58.96 -33.05 70.19 Favored 'General case' 0 CA--C 1.56 1.338 0 O-C-N 123.998 0.811 . . . . 74.12 111.522 179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -67.48 -57.65 6.15 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.549 0.739 . . . . 55.2 112.023 176.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 15.0 ptp180 -82.53 -15.55 51.96 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 113.015 0.746 . . . . 75.13 113.015 -172.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.605 ' SG ' HD23 ' A' ' 31' ' ' LEU . 49.2 t -68.98 -28.37 66.55 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 118.097 0.408 . . . . 72.11 111.967 -178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -82.12 -5.26 58.3 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.458 0.303 . . . . 65.14 111.71 179.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -60.86 -39.43 89.12 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 123.412 0.685 . . . . 53.11 109.608 172.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.611 ' SD ' ' HA ' ' A' ' 80' ' ' SER . 3.3 mpp? -64.7 104.29 0.8 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.389 -0.823 . . . . 75.51 109.658 173.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -31.78 71.15 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.526 0.73 . . . . 75.55 109.398 172.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.483 ' O ' ' HB3' ' A' ' 21' ' ' MET . 87.2 m-85 -91.89 169.68 10.48 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 114.577 -1.192 . . . . 74.51 109.017 170.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.648 ' SG ' HG21 ' A' ' 85' ' ' ILE . 56.7 m 56.41 56.24 5.87 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 122.255 1.026 . . . . 63.53 110.204 -172.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -68.87 -47.13 66.68 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.564 -1.653 . . . . 73.12 109.961 -174.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.563 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.1 mtpm? -82.0 -17.72 45.9 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 114.889 -1.05 . . . . 74.52 109.824 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.667 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 10.7 mm-40 -70.62 -38.82 73.98 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 110.324 -0.25 . . . . 73.14 110.324 168.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.546 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 52.5 t -67.52 -32.92 74.04 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 123.843 0.715 . . . . 70.41 110.041 174.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -62.44 -62.98 1.38 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 122.772 0.429 . . . . 74.32 111.854 172.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.408 HH12 ' ND2' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -60.6 -41.21 94.29 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 122.627 0.371 . . . . 75.44 111.875 -176.662 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.605 HD23 ' SG ' ' A' ' 18' ' ' CYS . 60.1 tp -65.24 -59.61 3.88 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.586 0.354 . . . . 60.42 110.074 179.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.48 -40.77 92.77 Favored Glycine 0 C--N 1.345 1.046 0 O-C-N 124.41 1.068 . . . . 70.51 113.459 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.9 t-80 -65.69 -49.34 68.88 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.522 0.729 . . . . 55.44 111.102 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.547 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 55.3 mtt-85 -57.09 -58.41 8.31 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.859 0.725 . . . . 62.52 110.147 175.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.472 HG21 HG21 ' A' ' 14' ' ' ILE . 54.5 t -52.1 -45.99 42.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 C-N-CA 124.048 0.939 . . . . 72.21 111.672 -175.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 85.3 mt -61.18 -45.75 93.32 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 123.438 0.461 . . . . 72.41 110.878 176.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.51 -24.45 69.4 Favored Glycine 0 CA--C 1.533 1.211 0 O-C-N 123.164 0.29 . . . . 63.02 113.647 178.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.624 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 30.2 mt -85.86 -51.6 6.29 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 123.488 0.715 . . . . 73.54 111.401 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.441 HG21 ' HA3' ' A' ' 11' ' ' GLY . 17.0 pt -72.66 -40.81 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-O 118.422 -0.799 . . . . 74.25 111.214 -173.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 23.8 tptm -51.33 -50.54 75.53 Favored Pre-proline 0 N--CA 1.49 1.571 0 N-CA-C 113.778 1.029 . . . . 72.52 113.778 -170.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.429 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 51.0 Cg_exo -57.48 -41.57 70.49 Favored 'Trans proline' 0 C--N 1.387 2.595 0 C-N-CA 121.726 1.617 . . . . 62.34 112.569 176.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.98 -25.51 59.97 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 115.185 -0.916 . . . . 64.45 111.218 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.756 ' HG2' HG23 ' A' ' 8' ' ' ILE . 38.5 mt-10 -67.69 -44.03 78.72 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.034 0.934 . . . . 73.32 109.562 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.432 ' O ' ' HG2' ' A' ' 48' ' ' GLN . 30.3 mmt -59.69 -47.35 85.97 Favored 'General case' 0 CA--C 1.539 0.538 0 O-C-N 124.701 1.25 . . . . 64.45 110.165 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.2 -30.92 63.85 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.716 0.806 . . . . 54.45 112.071 -177.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.53 -29.86 61.55 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.94 0.896 . . . . 74.25 109.679 177.048 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.04 -50.43 13.13 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.623 0.769 . . . . 74.35 109.94 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 44' ' ' MET . 30.6 mm-40 -63.05 -52.9 60.99 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 123.538 0.735 . . . . 73.32 109.708 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -101.53 -138.24 10.08 Favored Glycine 0 C--N 1.346 1.118 0 N-CA-C 111.199 -0.76 . . . . 64.02 111.199 174.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.99 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.859 0.863 . . . . 73.11 109.312 176.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -74.56 117.25 16.17 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.235 -0.893 . . . . 71.12 109.904 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.437 ' OG ' HD12 ' A' ' 4' ' ' LEU . 3.2 m -76.69 155.73 33.11 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 123.311 0.644 . . . . 63.53 109.993 -179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 p -123.45 77.47 54.32 Favored Pre-proline 0 CA--C 1.557 1.216 0 N-CA-C 108.231 -1.026 . . . . 70.21 108.231 170.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.48 ' HA ' HD23 ' A' ' 58' ' ' LEU . 62.1 Cg_endo -97.88 160.64 0.87 Allowed 'Trans proline' 0 C--N 1.378 2.115 0 C-N-CA 123.144 2.563 . . . . 74.12 113.385 -175.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 78.4 p -77.58 173.93 11.47 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 162.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.13 -43.39 98.54 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.335 0.654 . . . . 74.11 110.485 178.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.8 pptp? -74.77 -21.97 59.03 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.831 -0.622 . . . . 73.33 112.147 179.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.822 HD13 HD11 ' A' ' 115' ' ' LEU . 13.0 tp -81.22 -30.69 34.17 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.29 0.636 . . . . 72.21 110.316 174.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 69.8 m -63.45 -45.35 91.29 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.435 -0.95 . . . . 52.22 108.435 170.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.467 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 57.2 m -60.58 -44.25 96.43 Favored 'General case' 0 CA--C 1.545 0.753 0 O-C-N 124.401 1.063 . . . . 71.03 111.244 174.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.51 -42.99 98.46 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.6 0.76 . . . . 51.14 111.275 -177.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.45 -30.67 69.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.164 0.586 . . . . 62.04 111.042 176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -74.15 -32.92 63.33 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.133 0.573 . . . . 64.42 111.164 175.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.8 mtt180 -65.21 -47.1 78.07 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 109.143 -0.688 . . . . 73.33 109.143 175.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.624 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 4.5 t80 -65.51 -45.49 83.34 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 113.673 -1.603 . . . . 75.41 109.772 -175.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 3' ' ' ASN . 34.4 tttm -49.67 -57.71 6.7 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 113.915 -1.493 . . . . 75.22 110.269 169.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.402 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -62.91 -31.47 72.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.704 0.802 . . . . 70.41 111.824 -176.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.589 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -70.0 -37.75 75.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.911 0.884 . . . . 73.21 111.164 179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 97.0 mt -81.03 -21.14 40.37 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.152 0.581 . . . . 75.52 110.541 178.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 78.1 mt-10 -72.55 -38.13 68.07 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.352 0.661 . . . . 61.13 110.05 171.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 48.3 mt-10 -64.67 -50.21 67.94 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.696 -0.684 . . . . 73.54 109.381 174.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -57.07 -48.18 79.2 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 124.279 0.987 . . . . 72.13 111.71 179.7 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -56.54 -42.73 78.98 Favored 'General case' 0 N--CA 1.479 1.009 0 O-C-N 124.436 1.085 . . . . 73.41 110.704 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.24 -36.49 89.84 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.646 0.592 . . . . 64.21 113.218 177.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 29.2 mm-40 -63.08 -55.51 24.83 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 109.941 -0.392 . . . . 71.32 109.941 179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.629 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.3 pt -69.03 -20.18 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.366 0.666 . . . . 72.32 112.404 179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -62.06 -46.66 88.15 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 122.973 0.509 . . . . 72.33 109.92 167.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -82.84 -24.33 33.35 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 112.349 0.5 . . . . 64.52 112.349 178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.629 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.0 m-85 -81.18 -12.3 59.22 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.543 0.737 . . . . 74.42 111.239 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.611 ' HA ' ' SD ' ' A' ' 21' ' ' MET . 96.9 p -55.78 -28.71 57.49 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.669 0.606 . . . . 54.21 110.568 176.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -82.74 104.82 13.26 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.406 -1.331 . . . . 72.21 107.406 162.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -69.67 -23.73 63.5 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.728 0.811 . . . . 71.44 110.3 -172.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -63.34 -35.87 81.81 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 115.16 -0.927 . . . . 74.5 111.884 174.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.7 t-20 -58.55 -46.37 87.0 Favored 'General case' 0 C--O 1.256 1.44 0 C-N-CA 124.262 1.025 . . . . 75.53 109.795 175.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.648 HG21 ' SG ' ' A' ' 24' ' ' CYS . 30.7 mt -56.12 -57.43 8.56 Favored 'Isoleucine or valine' 0 C--N 1.356 0.877 0 CA-C-N 115.229 -0.896 . . . . 73.11 109.766 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.2 t -56.53 -34.9 67.48 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 124.358 1.036 . . . . 25.34 111.504 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -66.06 -45.37 81.57 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.529 0.732 . . . . 64.54 111.702 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.39 -22.81 32.64 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 121.122 -0.231 . . . . 74.41 110.418 178.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.5 tp -79.19 -29.44 42.9 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.934 0.894 . . . . 73.53 111.259 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.7 t -72.1 -17.2 62.0 Favored 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.84 -0.618 . . . . 61.32 110.873 176.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -121.49 16.43 11.26 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.66 1.184 . . . . 42.12 111.002 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.7 p -78.39 130.01 35.62 Favored 'General case' 0 C--N 1.354 0.791 0 N-CA-C 109.55 -0.537 . . . . 64.32 109.55 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -80.35 -11.04 59.75 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.284 0.634 . . . . 74.15 110.586 177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -124.8 164.11 20.69 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.587 1.155 . . . . 74.33 110.019 -177.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -90.11 -33.07 16.41 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.77 0.828 . . . . 72.12 110.18 176.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.412 ' N ' HD12 ' A' ' 96' ' ' ILE . 2.8 mp -80.88 122.73 36.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.61 0 C-N-CA 123.07 0.548 . . . . 63.22 109.561 -173.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.667 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 5.8 tp -68.14 -41.99 80.78 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.034 0.933 . . . . 72.33 110.849 -175.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.438 ' CD1' ' HB3' ' A' ' 97' ' ' LEU . 69.8 m-85 -106.49 36.86 2.47 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-N 114.046 -1.434 . . . . 75.25 109.889 -175.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.61 -58.52 5.63 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.78 0.832 . . . . 74.52 112.781 -175.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -64.7 -49.84 69.29 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.393 -0.821 . . . . 74.42 111.219 -177.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 91.4 t -59.79 -43.69 92.32 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 123.4 0.68 . . . . 75.24 111.006 -177.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.492 HD21 ' NH1' ' A' ' 34' ' ' ARG . 33.0 t30 -71.16 -28.05 63.98 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.193 0.997 . . . . 72.34 110.516 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.39 -35.03 79.72 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 108.845 -0.798 . . . . 74.13 108.845 173.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -64.55 -53.48 47.17 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 109.796 -0.446 . . . . 73.32 109.796 168.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.589 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.7 mp -52.07 -38.45 57.19 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 123.034 0.534 . . . . 70.45 111.348 178.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.0 t -74.48 -56.62 4.64 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.326 0.65 . . . . 71.22 110.471 -175.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -53.9 -55.21 28.98 Favored 'General case' 0 C--O 1.257 1.466 0 C-N-CA 124.547 1.139 . . . . 71.44 110.715 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 83.2 t -65.62 -50.26 72.69 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.933 0 CA-C-N 113.547 -1.661 . . . . 60.1 110.84 -175.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 68.9 t-105 -62.54 -37.39 85.93 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 118.687 0.676 . . . . 72.22 111.478 -177.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.8 mtpp -56.69 -60.3 3.76 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 123.541 0.525 . . . . 64.51 109.764 174.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -54.45 -42.29 70.43 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 124.028 0.83 . . . . 73.32 111.315 177.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 6.1 tt -67.01 -58.48 4.85 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.192 1.397 . . . . 74.35 110.156 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 86.2 p -59.09 -41.16 87.41 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.594 0.757 . . . . 63.43 111.602 179.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.19 -46.29 84.57 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.094 0.557 . . . . 72.1 112.286 179.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.822 HD11 HD13 ' A' ' 58' ' ' LEU . 4.2 pp -72.4 -22.94 61.05 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 122.271 -0.268 . . . . 64.15 110.706 -179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 122' ' ' MET . 88.1 mt -72.79 -36.01 67.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.402 0.681 . . . . 71.43 110.616 171.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -38.72 86.35 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 75.45 109.756 171.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 97.2 t -68.99 -60.49 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.085 0 C-N-CA 123.53 0.732 . . . . 61.34 111.558 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -77.16 -60.93 2.16 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.622 0.769 . . . . 70.15 111.358 -172.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -93.63 -2.63 53.81 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 114.935 -1.03 . . . . 62.41 111.2 -166.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 62.34 15.78 7.96 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.307 1.043 . . . . 73.21 110.72 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.606 ' HG2' HG23 ' A' ' 124' ' ' VAL . 40.2 ttm -66.61 116.84 38.59 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 123.814 0.846 . . . . 55.35 110.334 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -82.7 13.92 2.46 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 123.315 2.677 . . . . 65.52 113.231 -168.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.606 HG23 ' HG2' ' A' ' 122' ' ' MET . 45.2 t -74.24 108.69 5.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.602 0 C-N-CA 123.284 0.634 . . . . 73.43 110.13 -177.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.1 t -156.0 68.85 4.98 Favored Pre-proline 0 CA--C 1.549 0.917 0 CA-C-N 115.75 -0.659 . . . . 65.35 109.446 175.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.38 -24.32 10.81 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.234 1.956 . . . . 73.51 111.02 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 12.0 tt -80.88 -31.51 12.28 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 C-N-CA 124.856 1.262 . . . . 54.44 110.33 -179.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.2 m 60.04 -77.68 0.02 OUTLIER 'General case' 0 C--N 1.361 1.079 0 C-N-CA 125.361 1.464 . . . . 64.23 111.256 -172.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -48.13 2.94 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.675 0.79 . . . . 71.2 109.017 -179.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 121.5 11.01 6.26 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 115.798 -0.637 . . . . 72.12 112.314 -167.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.43 -42.51 98.69 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 123.748 0.819 . . . . 72.13 110.886 176.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 33.1 p -60.94 -46.3 91.26 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.111 -0.95 . . . . 70.22 110.378 174.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 12.2 m0 -62.18 -23.74 66.78 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.209 1.003 . . . . 65.52 113.006 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -72.0 -48.95 41.04 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-O 120.821 0.343 . . . . 74.2 110.828 173.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -70.05 -35.85 74.58 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.471 -0.786 . . . . 75.2 112.019 -178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -60.67 -49.14 78.7 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.409 0.683 . . . . 73.44 111.191 -177.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -73.93 -39.78 63.57 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.731 -0.668 . . . . 72.33 112.011 -175.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -58.28 -59.0 6.0 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 109.618 -0.512 . . . . 73.14 109.618 176.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -52.7 -61.75 2.09 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 124.603 1.189 . . . . 54.14 111.095 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -64.98 -50.74 65.16 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 115.077 -0.965 . . . . 74.45 111.489 -168.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.467 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -73.17 -28.9 62.48 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 123.813 0.696 . . . . 25.04 112.507 -172.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -68.18 -47.09 68.88 Favored 'General case' 0 N--CA 1.481 1.114 0 N-CA-C 109.784 -0.45 . . . . 71.43 109.784 175.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -63.43 -37.06 85.83 Favored 'General case' 0 N--CA 1.484 1.25 0 O-C-N 123.915 0.759 . . . . 75.42 111.828 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 25.4 t0 -78.36 -42.92 29.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.94 0.896 . . . . 43.33 110.923 -171.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.4 tmm_? -63.6 -40.62 97.41 Favored 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 108.338 -0.986 . . . . 71.11 108.338 175.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -60.0 -46.89 88.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.043 0.937 . . . . 71.24 110.859 175.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.38 -23.22 60.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.343 0.657 . . . . 74.21 111.632 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.448 ' HE2' ' HG ' ' A' ' 24' ' ' CYS . 0.8 OUTLIER -73.04 -57.13 4.25 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.171 0.588 . . . . 65.33 109.462 178.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.0 mm-40 -74.33 -47.29 35.48 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.341 -0.845 . . . . 74.03 110.599 -173.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 38.5 ttm -89.35 73.46 7.96 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 107.151 -1.425 . . . . 74.42 107.151 168.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 17.5 tp -84.0 66.31 9.13 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-N 115.069 -0.969 . . . . 72.02 109.8 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.2 tpt180 -102.19 -31.78 10.41 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.487 0.715 . . . . 75.13 110.476 -175.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.9 ttt180 -62.03 -65.67 0.65 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.366 0.666 . . . . 62.21 110.263 177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -131.68 108.25 9.36 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 115.994 -0.548 . . . . 71.11 110.483 -169.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -139.02 76.05 1.55 Allowed 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.46 1.104 . . . . 73.11 108.252 175.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 . . . . . 0 CA--C 1.558 1.268 0 C-N-CA 124.963 1.305 . . . . 53.41 111.089 -177.076 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ptm . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 119.419 -0.324 . . . . 74.23 111.293 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 52.24 -75.67 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 126.762 2.025 . . . . 72.12 112.167 173.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -48.58 -45.17 37.56 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 125.027 1.331 . . . . 64.34 109.997 173.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.9 mt -57.37 -43.25 83.41 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.747 -1.115 . . . . 64.13 111.949 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -59.13 -46.68 87.73 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.565 0.541 . . . . 71.12 110.16 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -62.6 -43.55 98.53 Favored 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 115.927 -0.578 . . . . 62.42 111.618 -179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.9 mt -59.78 -48.77 86.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 124.3 1.04 . . . . 73.24 110.96 179.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 61.7 mt -62.68 -42.25 95.4 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 CA-C-N 114.602 -1.181 . . . . 75.44 111.151 179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.433 ' O ' HG23 ' A' ' 13' ' ' VAL . 96.5 m -61.02 -50.56 72.87 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.368 0.667 . . . . 70.41 110.252 178.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 87.5 mt -60.2 -42.23 94.64 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.6 0.76 . . . . 71.24 111.019 -177.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.46 -42.12 99.7 Favored Glycine 0 C--N 1.349 1.254 0 O-C-N 123.618 0.574 . . . . 60.43 112.887 177.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -65.35 -43.03 92.18 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 122.268 0.227 . . . . 54.43 111.242 175.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 9' ' ' THR . 86.2 t -61.71 -35.32 66.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.637 0.775 . . . . 73.34 110.526 177.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 53.8 mt -59.88 -61.02 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 124.326 1.05 . . . . 70.2 110.439 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -61.9 -33.12 73.65 Favored 'General case' 0 N--CA 1.479 1.0 0 O-C-N 123.644 0.59 . . . . 74.41 111.187 -175.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -62.21 -60.73 3.16 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.267 1.027 . . . . 72.0 110.825 177.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -78.57 -17.18 56.51 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.134 0.573 . . . . 73.44 112.514 -172.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 48.5 t -60.95 -16.75 46.25 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.22 1.008 . . . . 61.52 111.49 175.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -58.39 -16.27 14.05 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.61 0.764 . . . . 71.54 112.685 174.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 54.3 mm-40 -62.3 -30.73 71.35 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.613 0.765 . . . . 74.25 111.818 174.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 8.5 mmt -67.85 90.38 0.29 Allowed 'General case' 0 N--CA 1.477 0.896 0 CA-C-O 120.909 0.385 . . . . 63.52 110.264 -175.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.75 -49.43 53.13 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 107.806 -1.183 . . . . 73.32 107.806 173.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -93.63 -179.51 5.04 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 113.53 -1.668 . . . . 73.13 109.721 170.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.592 ' SG ' HG21 ' A' ' 85' ' ' ILE . 34.1 m 53.01 56.24 7.83 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-O 122.199 1.0 . . . . 74.22 110.008 -167.502 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.87 -49.83 41.83 Favored 'General case' 0 C--O 1.241 0.627 0 CA-C-N 113.109 -1.86 . . . . 73.15 110.624 -169.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 68.1 tttt -74.1 -39.77 63.16 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.807 -1.088 . . . . 73.53 108.975 -174.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 14.5 mt-30 -65.12 -27.01 68.44 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.31 0.644 . . . . 63.35 112.031 173.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.3 t -77.24 -35.33 55.51 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 122.605 0.362 . . . . 53.14 110.656 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -70.07 -33.4 71.86 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-N 116.412 -0.358 . . . . 61.22 110.416 172.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.488 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 0.0 OUTLIER -67.94 -58.18 4.97 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.62 0.768 . . . . 74.14 109.822 179.699 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.3 tp -56.97 -44.91 83.12 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.417 1.087 . . . . 73.4 110.359 178.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.58 -49.61 72.19 Favored Glycine 0 C--N 1.346 1.139 0 O-C-N 124.064 0.852 . . . . 41.0 112.87 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -65.9 -38.01 87.61 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.874 0.47 . . . . 70.32 111.399 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.436 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 83.3 mtt-85 -60.0 -53.59 56.08 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.059 0.543 . . . . 71.14 110.672 178.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 39' ' ' ILE . 61.9 t -59.5 -50.49 79.72 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.425 0 O-C-N 124.25 0.968 . . . . 51.34 110.846 -177.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.52 -46.49 85.79 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.6 0.563 . . . . 74.22 111.426 -178.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.52 -19.15 74.36 Favored Glycine 0 N--CA 1.468 0.828 0 O-C-N 123.303 0.377 . . . . 53.31 113.367 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 13.8 tp -86.64 -48.16 8.55 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 123.658 0.783 . . . . 64.45 111.663 177.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.442 HG12 ' O ' ' A' ' 35' ' ' VAL . 14.0 pt -79.54 -34.73 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 CA-C-O 119.366 -0.35 . . . . 64.14 111.373 -173.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.404 ' O ' ' HG2' ' A' ' 44' ' ' MET . 87.5 tttt -57.33 -51.84 78.67 Favored Pre-proline 0 N--CA 1.488 1.449 0 N-CA-C 113.843 1.053 . . . . 73.53 113.843 -174.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.477 ' HB2' HG13 ' A' ' 124' ' ' VAL . 30.2 Cg_endo -60.32 -31.78 93.28 Favored 'Trans proline' 0 C--N 1.386 2.542 0 C-N-CA 121.573 1.515 . . . . 51.01 112.042 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -70.69 -40.99 72.58 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.169 0.588 . . . . 65.31 110.52 173.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -61.64 -37.36 83.72 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.568 0.747 . . . . 60.24 111.016 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.404 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -59.0 -55.05 40.21 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.909 0.756 . . . . 74.32 111.173 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.7 pp -77.42 -33.68 54.88 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-N 115.519 -0.764 . . . . 55.52 112.355 -175.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.81 -43.54 62.58 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.311 0.644 . . . . 74.05 110.066 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -65.12 -41.39 94.89 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.994 0.518 . . . . 75.44 110.377 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -63.95 -38.23 90.34 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.099 -0.955 . . . . 71.13 110.913 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -166.49 113.25 0.54 Allowed Glycine 0 C--N 1.337 0.627 0 N-CA-C 110.846 -0.902 . . . . 23.42 110.846 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.3 mptt -77.24 4.51 10.4 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.274 0.63 . . . . 73.44 111.054 -178.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 26.6 mmm180 -64.04 118.65 8.8 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.759 0.824 . . . . 65.51 110.872 -177.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 15.1 m -146.83 144.63 29.46 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 124.127 0.971 . . . . 54.34 108.404 177.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.408 ' H ' HE22 ' A' ' 120' ' ' GLN . 52.4 t -90.4 104.31 8.64 Favored Pre-proline 0 CA--C 1.544 0.729 0 N-CA-C 107.448 -1.316 . . . . 73.4 107.448 166.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.548 ' HA ' HD12 ' A' ' 58' ' ' LEU . 5.4 Cg_exo -79.25 86.85 1.62 Allowed 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 122.204 1.936 . . . . 45.14 110.471 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 64.6 p -76.59 177.22 7.65 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 115.648 -0.706 . . . . 72.41 109.302 171.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -58.95 -58.67 7.64 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.195 0.598 . . . . 72.43 111.044 -173.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -74.9 -18.61 60.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.345 0.498 . . . . 64.15 112.345 -177.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.548 HD12 ' HA ' ' A' ' 54' ' ' PRO . 3.5 tm? -65.9 -56.19 13.08 Favored 'General case' 0 N--CA 1.481 1.125 0 N-CA-C 108.085 -1.079 . . . . 64.44 108.085 175.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 m -62.21 -39.73 93.74 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 115.071 -0.968 . . . . 72.12 110.824 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.416 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 88.5 m -61.44 -44.81 96.47 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.542 0.737 . . . . 73.43 111.36 178.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.98 -41.85 86.08 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.142 0.577 . . . . 63.14 110.772 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 22.7 mmt -65.83 -27.82 68.53 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 123.746 0.654 . . . . 61.51 111.037 176.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -75.0 -41.27 59.8 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.144 0.577 . . . . 63.32 110.463 176.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 60' ' ' THR . 87.8 mtt180 -62.2 -40.55 96.44 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.31 0.576 . . . . 73.34 110.161 174.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.6 OUTLIER -65.88 -56.75 10.21 Favored 'General case' 0 C--O 1.216 -0.666 0 CA-C-N 114.422 -1.263 . . . . 75.33 109.277 -177.45 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 15.0 tmtt? -55.04 -41.28 71.21 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.876 1.27 . . . . 64.1 110.713 179.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -63.91 -41.08 97.78 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.357 0.663 . . . . 60.42 111.296 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.544 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -67.4 -39.48 85.57 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.614 0.766 . . . . 64.22 111.156 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.422 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.4 mm? -67.02 -32.31 73.45 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.539 0.736 . . . . 74.31 111.002 174.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 46.8 mt-10 -68.08 -40.64 82.64 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.138 0.575 . . . . 72.25 111.288 173.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.9 mt-10 -67.92 -38.75 83.3 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.167 0.587 . . . . 72.22 110.11 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.469 ' HA ' ' HE2' ' A' ' 98' ' ' PHE . . . -64.71 -45.85 84.82 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 123.113 0.565 . . . . 71.35 110.603 176.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -59.51 -38.97 82.33 Favored 'General case' 0 C--O 1.248 0.993 0 C-N-CA 124.675 1.19 . . . . 63.23 110.561 177.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.3 -40.36 80.89 Favored Glycine 0 C--N 1.344 0.996 0 CA-C-N 114.894 -1.048 . . . . 75.52 112.472 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.487 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 24.0 mm-40 -68.07 -45.23 74.41 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 118.976 -0.535 . . . . 74.34 111.208 -178.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.603 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.7 OUTLIER -68.02 -26.39 34.4 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 CA-C-N 118.525 0.602 . . . . 63.24 111.544 175.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.76 -35.06 79.87 Favored 'General case' 0 N--CA 1.483 1.202 0 CA-C-O 121.031 0.443 . . . . 64.3 110.315 171.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -76.43 -38.39 55.58 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.264 0.626 . . . . 63.43 110.847 174.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 23.1 m-85 -75.01 -7.41 53.57 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.906 0.882 . . . . 65.43 112.596 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 91.4 p -57.72 -33.09 68.05 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-O 121.18 0.514 . . . . 71.22 110.308 176.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.05 109.81 5.35 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 107.721 -1.214 . . . . 73.33 107.721 164.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.0 mmt85 -67.57 -30.21 69.77 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 123.563 0.745 . . . . 64.13 111.022 -170.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.6 m -72.99 -27.17 61.64 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.153 -0.93 . . . . 60.5 111.67 178.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -60.85 -40.98 94.96 Favored 'General case' 0 C--O 1.257 1.464 0 C-N-CA 123.794 0.838 . . . . 53.24 110.866 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.592 HG21 ' SG ' ' A' ' 24' ' ' CYS . 16.0 mt -61.06 -55.3 25.64 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 115.165 -0.925 . . . . 74.12 109.252 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.8 t -59.1 -31.07 68.59 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.455 0.702 . . . . 72.55 111.607 179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 27.0 tpt180 -63.17 -47.62 81.87 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.335 1.054 . . . . 50.44 111.321 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -79.19 -29.84 43.1 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 120.243 -0.583 . . . . 72.02 110.285 175.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.44 ' HA ' ' HB3' ' A' ' 92' ' ' SER . 6.8 tp -74.49 -27.0 60.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.682 0.793 . . . . 44.12 111.512 -169.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.3 t -71.88 -22.1 61.56 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.947 0.499 . . . . 43.53 110.842 177.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.44 -35.72 13.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.901 0.88 . . . . 72.44 110.145 174.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.44 ' HB3' ' HA ' ' A' ' 89' ' ' LEU . 32.1 t -71.61 131.74 43.64 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.116 0.967 . . . . 62.33 110.974 179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -96.45 -47.33 6.01 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.707 0.803 . . . . 74.11 110.318 175.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -149.46 13.68 0.85 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.037 0.935 . . . . 75.45 110.317 177.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 14.1 tmtt? -70.54 101.02 1.91 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 106.854 -1.536 . . . . 55.34 106.854 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 12.4 mm -58.22 150.99 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 124.324 1.049 . . . . 73.34 110.103 -169.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.406 HD13 ' SG ' ' A' ' 24' ' ' CYS . 5.4 tp -49.47 -40.58 37.6 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.389 0.676 . . . . 63.42 111.529 -178.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.603 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 36.1 m-85 -124.38 42.42 3.26 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.681 -1.145 . . . . 74.34 109.993 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 4.9 tmtm? -49.87 -66.1 0.45 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.556 0.743 . . . . 73.14 110.461 -178.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -67.18 -46.78 72.93 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 124.088 0.868 . . . . 65.12 111.293 -175.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 37.8 t -67.58 -55.97 15.06 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-N 115.582 -0.736 . . . . 72.45 111.315 -172.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.534 ' HB3' ' O ' ' A' ' 98' ' ' PHE . 13.8 t30 -63.38 -28.41 69.97 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.999 0.92 . . . . 74.1 111.012 177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -61.57 -42.85 99.45 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 110.146 -0.316 . . . . 72.22 110.146 170.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -59.45 -48.44 81.63 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 123.351 0.407 . . . . 74.11 110.764 173.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.544 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.0 mp -55.52 -41.63 73.39 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.537 0.335 . . . . 73.33 110.465 178.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.1 t -64.83 -52.92 54.13 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 124.151 0.98 . . . . 73.23 111.012 -179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.7 m-20 -65.76 -46.55 78.4 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.672 0.789 . . . . 75.23 111.787 -175.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 85.2 t -66.99 -35.9 75.83 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 C-N-CA 122.714 0.406 . . . . 65.31 110.545 179.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.521 ' HH2' HG12 ' A' ' 124' ' ' VAL . 21.4 t-105 -62.74 -41.57 99.25 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.706 0.402 . . . . 71.53 110.8 174.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtpt -56.33 -56.16 24.5 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 123.465 0.478 . . . . 75.13 109.746 175.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -56.55 -38.97 72.62 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.217 1.007 . . . . 62.41 111.331 178.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.0 OUTLIER -66.14 -59.62 3.59 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.237 0.961 . . . . 72.4 109.072 -173.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.6 p -59.06 -33.2 70.5 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.07 0.948 . . . . 70.51 111.195 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.468 ' O ' HG23 ' A' ' 118' ' ' VAL . 70.8 mt -60.55 -63.85 1.16 Allowed 'General case' 0 C--N 1.358 0.946 0 O-C-N 123.752 0.657 . . . . 64.24 111.193 173.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -63.02 -29.86 71.15 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 112.34 0.496 . . . . 71.23 112.34 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 88.4 mt -66.78 -45.42 78.5 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.854 0.862 . . . . 73.52 110.603 175.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 114' ' ' LEU . 2.4 pt20 -76.97 -20.29 56.27 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.079 0.152 . . . . 62.42 111.365 -179.288 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 114' ' ' LEU . 54.7 t -71.72 -60.29 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 123.342 0.657 . . . . 65.04 110.749 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -89.96 -58.48 2.49 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.324 0.583 . . . . 74.42 111.781 -175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.408 HE22 ' H ' ' A' ' 53' ' ' VAL . 15.3 mm-40 -77.8 -12.86 60.01 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 115.137 -0.938 . . . . 75.15 110.855 -170.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.456 ' O ' ' HD3' ' A' ' 121' ' ' ARG . 0.0 OUTLIER 64.17 18.13 11.08 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 125.341 1.457 . . . . 72.53 110.787 -179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.551 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 87.9 mtp -64.12 112.66 8.02 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.498 0.719 . . . . 71.52 110.038 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -87.03 41.22 0.73 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 123.821 3.014 . . . . 71.12 110.753 -176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.523 HG23 ' HB3' ' A' ' 122' ' ' MET . 20.1 t -88.11 87.78 2.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 114.629 -1.169 . . . . 72.03 108.76 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 10.9 t -164.07 69.44 1.62 Allowed Pre-proline 0 CA--C 1.547 0.864 0 CA-C-N 114.307 -1.315 . . . . 62.35 108.177 171.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -76.8 3.84 6.18 Favored 'Trans proline' 0 C--N 1.387 2.559 0 C-N-CA 122.884 2.39 . . . . 73.14 112.334 -179.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 20.4 tt -116.24 -10.11 12.12 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 124.668 1.187 . . . . 74.14 110.231 177.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.9 t 64.83 -152.34 0.28 Allowed 'General case' 0 C--N 1.36 1.063 0 C-N-CA 124.596 1.158 . . . . 72.42 109.328 -174.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.505 HE21 ' HB2' ' A' ' 131' ' ' ALA . 12.9 pt20 -58.51 -29.58 66.39 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.415 0.686 . . . . 73.04 111.907 174.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.47 ' O ' ' HB2' ' A' ' 133' ' ' TRP . . . 73.53 53.95 7.08 Favored Glycine 0 C--N 1.353 1.476 0 O-C-N 123.624 0.578 . . . . 73.32 112.211 -178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.505 ' HB2' HE21 ' A' ' 129' ' ' GLN . . . -64.12 -26.8 68.7 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.433 0.693 . . . . 74.52 111.333 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 63.2 p -63.1 -37.87 88.92 Favored 'General case' 0 C--O 1.217 -0.647 0 CA-C-N 115.099 -0.955 . . . . 72.25 111.193 174.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.47 ' HB2' ' O ' ' A' ' 130' ' ' GLY . 0.6 OUTLIER -50.2 -45.66 53.87 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.593 1.157 . . . . 72.3 113.091 -174.828 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.78 -36.03 79.74 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.009 0.523 . . . . 52.31 111.577 -178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -74.75 -36.27 62.59 Favored 'General case' 0 C--O 1.257 1.452 0 C-N-CA 123.301 0.64 . . . . 64.42 110.313 179.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.488 ' HB3' ' HD3' ' A' ' 30' ' ' ARG . 37.7 mt-10 -58.16 -62.5 1.78 Allowed 'General case' 0 C--N 1.355 0.818 0 CA-C-N 114.338 -1.301 . . . . 75.41 109.184 -178.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 89.8 m-20 -52.57 -37.06 57.16 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 124.041 0.838 . . . . 74.12 112.748 -177.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -63.4 -60.63 3.12 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.267 0.354 . . . . 73.41 110.571 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.29 -36.33 83.75 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.456 1.122 . . . . 73.43 110.0 -176.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -67.67 -63.63 1.02 Allowed 'General case' 0 C--O 1.239 0.52 0 CA-C-N 113.493 -1.685 . . . . 61.25 110.32 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.402 ' O ' ' HB2' ' A' ' 145' ' ' ARG . . . -63.83 -25.23 68.08 Favored 'General case' 0 C--O 1.222 -0.353 0 O-C-N 124.372 1.045 . . . . 60.32 111.564 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 146' ' ' ARG . 17.4 t70 -60.42 -63.5 1.28 Allowed 'General case' 0 C--N 1.361 1.081 0 N-CA-C 109.526 -0.546 . . . . 72.2 109.526 175.318 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.8 -32.0 73.48 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 123.694 0.621 . . . . 63.22 112.116 -177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -71.65 -35.79 70.49 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.083 0.553 . . . . 74.03 110.644 -178.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 141' ' ' ALA . 3.9 tmt_? -67.0 -39.78 87.19 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.929 0.892 . . . . 65.22 109.216 174.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.515 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 12.2 mmt180 -61.34 -48.77 79.81 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 123.508 0.505 . . . . 75.41 110.0 177.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -67.68 -30.32 69.82 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.436 0.695 . . . . 63.31 111.993 -175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.86 -58.89 3.07 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.569 0.543 . . . . 74.22 110.275 176.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 37.2 mm-40 -75.2 -53.13 9.34 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.324 0.65 . . . . 63.22 111.313 -170.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.8 ttm -86.14 71.22 10.58 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.057 -1.46 . . . . 51.12 107.057 167.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 44.6 tp -74.75 107.86 7.12 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.196 -0.911 . . . . 73.04 108.901 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -147.31 -56.83 0.25 Allowed 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 106.709 -1.589 . . . . 73.53 106.709 -173.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -89.55 85.21 6.44 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 115.006 -0.997 . . . . 74.33 108.545 176.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 30.3 t70 170.99 -65.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 126.369 1.867 . . . . 72.54 106.97 171.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -155.79 164.01 39.1 Favored 'General case' 0 C--O 1.241 0.635 0 CA-C-N 114.661 -1.154 . . . . 73.01 108.203 175.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 . . . . . 0 CA--C 1.554 1.114 0 C-N-CA 123.437 0.695 . . . . 75.11 109.448 177.441 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 38.5 ttp . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 120.247 0.07 . . . . 75.4 110.996 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -61.39 -30.66 70.69 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.64 1.176 . . . . 74.22 111.317 -175.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -60.86 -53.86 52.2 Favored 'General case' 0 N--CA 1.482 1.142 0 O-C-N 123.759 0.662 . . . . 61.31 109.51 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' HG12 ' A' ' 8' ' ' ILE . 52.8 mt -65.84 -36.53 83.71 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 114.587 -1.188 . . . . 74.03 111.29 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 7.2 tmtt? -58.95 -48.17 82.47 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.542 -0.91 . . . . 72.41 108.542 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.3 m-70 -70.21 -42.29 72.51 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-N 115.923 -0.58 . . . . 72.01 111.961 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.4 mt -56.62 -46.26 82.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 CA-C-O 121.265 0.555 . . . . 62.24 110.892 178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 4' ' ' LEU . 35.3 mm -72.72 -42.32 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.397 -0.819 . . . . 64.35 111.023 -176.114 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' HG23 ' A' ' 13' ' ' VAL . 86.6 m -64.34 -53.99 39.96 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.351 0.261 . . . . 73.11 110.453 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.9 mt -57.02 -51.5 69.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.925 0.89 . . . . 53.13 111.263 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.426 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -64.59 -32.04 82.88 Favored Glycine 0 C--N 1.344 1.021 0 O-C-N 123.907 0.755 . . . . 51.24 113.714 -177.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -73.5 -44.99 56.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 122.689 -0.301 . . . . 74.34 110.632 176.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.446 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 75.3 t -59.31 -35.89 60.7 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.309 0.643 . . . . 75.22 109.893 175.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.573 HG21 HG21 ' A' ' 35' ' ' VAL . 29.6 mt -57.5 -54.36 32.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.464 1.105 . . . . 72.12 109.882 171.726 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -53.85 -34.93 60.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.941 0.896 . . . . 64.34 111.463 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -77.45 -47.22 20.27 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 112.266 0.469 . . . . 73.11 112.266 178.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 13.3 ptp180 -83.76 -17.24 41.83 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 112.851 0.686 . . . . 72.31 112.851 -173.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.08 -24.87 67.58 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.035 0.534 . . . . 53.15 111.671 -176.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.8 -7.16 49.36 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.146 0.424 . . . . 74.54 112.146 179.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -61.14 -21.6 63.9 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.485 0.714 . . . . 74.01 111.612 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.441 ' HB3' ' O ' ' A' ' 23' ' ' TYR . 21.6 mmt -67.78 88.57 0.25 Allowed 'General case' 0 CA--C 1.549 0.938 0 O-C-N 124.013 0.821 . . . . 74.51 109.891 176.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.478 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 0.2 OUTLIER -69.93 -30.73 68.19 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.462 0.649 . . . . 71.24 109.901 170.343 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' MET . 53.0 m-85 -106.44 172.87 6.58 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.256 1.022 . . . . 74.52 108.472 167.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.548 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 66.4 m 58.95 73.91 0.46 Allowed 'General case' 0 CA--C 1.556 1.19 0 CA-C-O 121.456 0.646 . . . . 75.34 110.705 -170.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -69.99 -59.49 2.88 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.715 1.206 . . . . 73.3 110.665 -175.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 45.8 mmtm -68.33 -29.07 67.73 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-N 114.439 -1.255 . . . . 71.33 110.323 -175.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.433 ' HG2' ' CB ' ' A' ' 97' ' ' LEU . 0.3 OUTLIER -71.88 -40.18 69.11 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 123.611 0.569 . . . . 64.14 111.562 177.275 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 41.8 t -61.53 -41.32 97.17 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.315 0.578 . . . . 75.35 109.831 176.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 -77.27 -24.14 51.08 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.093 -0.958 . . . . 63.2 111.487 176.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 137' ' ' ASP . 0.1 OUTLIER -70.13 -57.82 4.51 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 122.077 0.941 . . . . 74.11 109.803 179.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -63.94 -44.97 91.21 Favored 'General case' 0 CA--C 1.544 0.746 0 CA-C-N 113.115 -1.857 . . . . 75.11 108.86 -178.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.58 -53.2 48.0 Favored Glycine 0 C--N 1.353 1.477 0 O-C-N 123.877 0.736 . . . . 63.34 113.625 177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -63.29 -45.44 91.43 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.219 0.607 . . . . 72.4 111.342 -175.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.616 HH12 ' HB2' ' A' ' 106' ' ' SER . 25.6 mtt-85 -58.35 -58.03 10.31 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 123.763 0.664 . . . . 73.13 110.913 178.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.573 HG21 HG21 ' A' ' 14' ' ' ILE . 79.2 t -56.94 -40.21 70.64 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.564 0.54 . . . . 75.52 111.358 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.411 HD23 HD11 ' A' ' 39' ' ' ILE . 71.7 mt -61.32 -48.39 81.56 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.589 0.356 . . . . 74.42 111.765 174.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.14 -21.44 61.68 Favored Glycine 0 N--CA 1.47 0.956 0 CA-C-N 116.613 -0.267 . . . . 74.23 113.202 178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 61.7 mt -87.02 -52.19 5.58 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.383 0.673 . . . . 73.25 112.442 175.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.446 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 24.1 pt -74.23 -42.74 51.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 118.63 -0.7 . . . . 62.11 111.766 -169.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.453 ' O ' ' HG2' ' A' ' 44' ' ' MET . 53.2 mtmt -56.43 -51.49 80.59 Favored Pre-proline 0 N--CA 1.489 1.483 0 CA-C-O 118.071 -0.966 . . . . 70.51 112.786 -173.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.421 ' HD3' ' HB2' ' A' ' 40' ' ' LYS . 77.8 Cg_exo -51.89 -45.64 37.25 Favored 'Trans proline' 0 C--N 1.4 3.249 0 C-N-CA 122.295 1.997 . . . . 75.02 112.334 174.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.464 HD13 HD21 ' A' ' 45' ' ' LEU . 4.5 mm? -66.39 -33.03 74.79 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.017 -0.992 . . . . 52.42 111.563 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 49.7 mt-10 -70.55 -35.17 72.96 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.403 0.681 . . . . 63.22 110.401 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.453 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 33.2 mmt -67.93 -47.13 69.57 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.477 0.485 . . . . 65.22 110.498 -178.275 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.464 HD21 HD13 ' A' ' 42' ' ' LEU . 4.2 pp -75.16 -30.87 60.87 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.744 0.418 . . . . 62.4 111.739 -178.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 37.5 tt0 -70.87 -35.43 72.37 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.325 0.65 . . . . 72.52 110.703 175.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -64.49 -55.2 22.31 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.177 0.591 . . . . 61.31 110.715 -178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -80.47 -19.31 46.28 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.532 -0.758 . . . . 65.54 111.826 -178.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -98.6 170.25 24.1 Favored Glycine 0 C--N 1.349 1.29 0 C-N-CA 122.989 0.328 . . . . 61.2 112.721 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 79.7 tttt -165.72 -61.12 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.621 0.768 . . . . 50.23 110.226 -176.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 14.9 ptm180 -89.45 26.13 1.77 Allowed 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.948 0.899 . . . . 75.42 110.792 -174.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 15.1 m -61.08 143.33 55.63 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 124.574 1.15 . . . . 73.4 110.342 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.4 t -108.14 102.35 45.81 Favored Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 123.526 0.73 . . . . 61.34 109.142 -176.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -85.01 -158.27 0.09 OUTLIER 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.353 2.702 . . . . 52.32 110.885 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.8 t -160.11 -177.44 6.29 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.182 0.593 . . . . 74.33 110.119 -175.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -61.8 -57.05 13.34 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 124.078 0.951 . . . . 72.34 111.55 -174.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 20.2 pttm -70.81 -23.64 62.4 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.816 0.446 . . . . 63.45 111.787 178.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.43 -48.29 73.27 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.273 -1.01 . . . . 71.23 108.273 176.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 43.3 m -68.41 -41.73 80.0 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.947 -1.024 . . . . 74.54 111.066 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 62.4 m -61.27 -40.53 94.44 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.307 0.643 . . . . 53.34 110.704 178.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.556 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -64.4 -44.69 90.5 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.98 0.512 . . . . 74.23 110.454 176.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.9 mmt -64.0 -25.86 68.32 Favored 'General case' 0 CA--C 1.558 1.278 0 O-C-N 123.92 0.763 . . . . 73.12 111.844 176.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -77.14 -44.75 29.2 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.843 0.857 . . . . 71.23 110.772 177.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.5 mtp85 -61.12 -40.6 94.37 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.042 0.937 . . . . 75.12 109.393 176.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -67.92 -51.61 45.79 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 114.099 -1.409 . . . . 75.3 110.002 -177.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 14.5 tmtt? -54.97 -47.95 73.88 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.933 1.293 . . . . 75.04 110.999 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.404 ' O ' ' HG3' ' A' ' 71' ' ' GLU . . . -65.25 -40.7 94.35 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 123.687 0.617 . . . . 60.14 111.407 -178.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.497 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -63.54 -41.57 98.44 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.21 0.604 . . . . 51.14 111.248 177.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.42 ' O ' HD11 ' A' ' 14' ' ' ILE . 11.0 mp -65.11 -32.17 73.74 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.335 0.654 . . . . 73.54 111.675 174.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 50.2 mt-10 -64.74 -40.91 96.12 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.685 0.394 . . . . 64.31 110.974 174.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.418 ' HB2' HG13 ' A' ' 101' ' ' VAL . 47.8 mt-10 -62.54 -49.69 74.29 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 123.629 0.581 . . . . 74.31 110.031 177.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.457 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.22 -44.02 92.3 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 123.96 0.787 . . . . 63.03 111.103 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -59.92 -44.69 94.16 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 125.152 1.381 . . . . 74.14 110.77 179.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.67 -39.43 93.73 Favored Glycine 0 C--N 1.343 0.952 0 CA-C-N 114.996 -1.002 . . . . 55.5 112.32 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -59.97 -57.89 10.9 Favored 'General case' 0 CA--C 1.541 0.626 0 CA-C-N 117.154 0.477 . . . . 54.45 110.302 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.457 HG12 ' O ' ' A' ' 72' ' ' ALA . 0.9 OUTLIER -63.55 -23.19 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 112.659 0.614 . . . . 75.24 112.659 177.453 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.406 ' HB2' ' NH1' ' A' ' 17' ' ' ARG . 33.4 tt0 -65.16 -44.64 87.9 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 122.584 0.354 . . . . 73.32 110.921 173.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -87.82 -19.11 27.91 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.513 0.325 . . . . 64.24 111.288 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.44 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 11.5 m-30 -82.0 0.84 38.39 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.43 0.692 . . . . 75.11 111.578 177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 74.1 p -57.47 -24.9 58.46 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.316 0.646 . . . . 72.15 110.668 169.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -85.35 95.59 9.28 Favored 'General case' 0 CA--C 1.552 1.022 0 N-CA-C 108.224 -1.028 . . . . 71.54 108.224 168.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.543 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -73.13 -31.63 64.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.715 0.806 . . . . 53.54 112.064 -169.434 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 69.8 p -74.11 -32.89 63.39 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.978 0.511 . . . . 72.33 110.803 176.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -66.43 -32.91 74.58 Favored 'General case' 0 C--O 1.249 1.06 0 C-N-CA 123.756 0.822 . . . . 70.42 109.964 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 36.9 mt -55.88 -53.05 42.38 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 109.017 -0.734 . . . . 73.51 109.017 171.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . 0.47 ' HB2' ' CE1' ' A' ' 148' ' ' PHE . 42.8 t -57.05 -39.35 74.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.909 0.884 . . . . 62.14 111.747 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -58.68 -51.24 70.78 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 114.994 -1.003 . . . . 64.11 110.891 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -77.41 -23.14 50.67 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.677 0.391 . . . . 63.34 110.831 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -72.21 -47.18 52.47 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.974 0.91 . . . . 74.43 110.506 -172.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -63.12 -29.04 70.48 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 115.838 -0.619 . . . . 63.33 110.415 176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -75.41 -34.41 61.03 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.59 0.756 . . . . 71.02 111.029 173.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.4 t -71.28 138.3 49.25 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.757 0.823 . . . . 73.31 109.899 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -90.12 -10.22 45.43 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 124.002 0.921 . . . . 54.11 110.821 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -106.1 149.15 27.02 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-O 121.501 0.667 . . . . 71.41 111.348 -178.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.617 ' HD2' ' HA ' ' A' ' 142' ' ' ASP . 51.0 mtmt -86.84 -27.45 23.48 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.897 1.279 . . . . 74.42 110.536 -179.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.487 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.5 mp -82.61 116.35 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 N-CA-C 107.45 -1.315 . . . . 72.41 107.45 178.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.433 ' CB ' ' HG2' ' A' ' 27' ' ' GLN . 13.5 tp -69.57 -32.85 71.86 Favored 'General case' 0 N--CA 1.482 1.156 0 CA-C-O 121.44 0.638 . . . . 63.22 111.157 -172.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -109.21 16.76 22.22 Favored 'General case' 0 C--O 1.209 -1.069 0 CA-C-N 115.033 -0.985 . . . . 74.2 111.669 -173.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 85.6 tttt -42.54 -57.35 2.7 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.96 1.467 . . . . 74.33 114.96 -163.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -67.67 -48.7 65.89 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.906 0.882 . . . . 74.33 111.255 -175.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.418 HG13 ' HB2' ' A' ' 71' ' ' GLU . 77.2 t -61.72 -52.72 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.948 0.899 . . . . 73.44 110.978 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 66.6 t30 -68.35 -26.32 65.53 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 124.873 1.269 . . . . 72.35 110.712 -177.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.438 ' NH1' ' HB2' ' A' ' 107' ' ' ASP . 15.3 tpt180 -61.35 -43.59 98.61 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.446 0.699 . . . . 71.05 109.845 168.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -60.26 -49.77 76.29 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-O 119.046 -0.502 . . . . 61.11 111.577 172.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.497 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.8 mp -55.33 -37.84 67.96 Favored 'General case' 0 N--CA 1.502 2.169 0 CA-C-N 118.607 0.639 . . . . 62.22 111.261 178.439 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.616 ' HB2' HH12 ' A' ' 34' ' ' ARG . 32.9 t -67.13 -53.03 34.47 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.804 0.842 . . . . 63.22 111.12 179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.576 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 5.7 t70 -78.43 -29.23 46.95 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.745 -0.661 . . . . 74.21 111.146 -170.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 70.3 t -79.46 -27.38 12.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 C-N-CA 122.947 0.499 . . . . 73.51 110.165 174.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.559 ' HH2' HG12 ' A' ' 124' ' ' VAL . 20.2 t-105 -65.45 -39.73 92.37 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-N 118.717 0.69 . . . . 73.51 110.21 168.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.576 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 49.2 mtpt -54.92 -59.05 5.27 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 123.494 0.496 . . . . 73.41 109.793 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.495 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 50.0 mt-10 -53.45 -47.96 69.26 Favored 'General case' 0 C--N 1.358 0.937 0 O-C-N 124.523 1.14 . . . . 51.13 110.568 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 2.6 tp -57.91 -59.66 4.9 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.382 1.073 . . . . 63.24 109.592 -173.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 34.3 t -55.08 -41.41 71.51 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.675 1.19 . . . . 64.05 112.103 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 95.7 mt -68.41 -47.21 67.87 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.074 -0.512 . . . . 73.43 111.996 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.556 HD21 ' HB2' ' A' ' 61' ' ' ALA . 4.2 pp -78.4 -19.29 53.6 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.818 -0.551 . . . . 72.02 111.43 179.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.449 ' HG ' ' HE2' ' A' ' 122' ' ' MET . 2.0 mp -63.46 -53.36 53.31 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.923 -0.769 . . . . 65.11 108.923 169.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -72.18 -27.69 62.72 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.651 0.38 . . . . 73.05 112.024 -177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 24.0 t -71.93 -63.77 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 122.852 0.461 . . . . 62.31 110.956 173.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -85.36 -58.23 2.76 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.486 0.715 . . . . 74.53 111.484 -165.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 60.8 tt0 -88.55 -2.97 58.89 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.284 0.634 . . . . 75.25 110.318 -176.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 54.85 35.85 25.21 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 125.73 1.612 . . . . 35.12 112.363 177.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.483 ' HB3' HG23 ' A' ' 124' ' ' VAL . 27.7 mtm -95.66 129.3 34.97 Favored Pre-proline 0 N--CA 1.477 0.917 0 O-C-N 121.669 -0.644 . . . . 63.12 110.336 177.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -89.41 30.87 0.39 Allowed 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.523 2.815 . . . . 53.13 112.11 -175.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.559 HG12 ' HH2' ' A' ' 109' ' ' TRP . 46.6 t -72.4 91.45 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 123.91 0.884 . . . . 62.31 110.437 -172.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.0 t -163.22 70.41 1.9 Allowed Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 124.02 0.928 . . . . 75.44 109.018 171.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -87.88 -3.28 7.24 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.889 2.393 . . . . 75.01 112.365 177.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.0 tt -121.55 19.4 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.954 1.302 . . . . 63.14 109.44 -171.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 35.2 t 69.71 -177.63 0.21 Allowed 'General case' 0 N--CA 1.479 1.011 0 CA-C-N 114.272 -1.331 . . . . 64.33 110.873 -177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -81.87 9.36 8.24 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.847 0.859 . . . . 71.2 110.685 175.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 94.96 29.74 8.87 Favored Glycine 0 C--N 1.342 0.873 0 N-CA-C 112.619 -0.192 . . . . 72.22 112.619 -173.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -71.09 -42.39 69.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.893 0.477 . . . . 44.32 110.445 177.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 23.8 m -65.82 -30.31 70.92 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-N 115.602 -0.726 . . . . 74.41 111.13 172.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.464 ' HA ' ' HG2' ' A' ' 136' ' ' GLU . 22.0 m0 -68.93 -23.99 64.23 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.753 1.02 . . . . 73.31 113.753 -170.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.77 -25.26 48.94 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-O 120.796 0.331 . . . . 71.55 111.557 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -89.71 -50.83 5.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.738 0.815 . . . . 62.45 111.126 -176.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 133' ' ' TRP . 11.5 pt-20 -57.05 -42.33 80.35 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.528 0.731 . . . . 42.44 111.754 -174.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.431 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 1.0 OUTLIER -60.09 -51.26 70.36 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.152 0.581 . . . . 63.32 112.012 -177.355 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -69.42 -39.27 77.97 Favored 'General case' 0 CA--C 1.55 0.98 0 O-C-N 123.219 0.324 . . . . 54.34 111.515 -175.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 78.9 mt-30 -66.99 -57.91 5.97 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 121.642 0.734 . . . . 50.51 111.3 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.614 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 1.2 m-20 -55.53 -51.92 65.45 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.194 -1.366 . . . . 73.4 111.119 179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -66.93 -27.26 67.34 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.286 0.476 . . . . 73.31 112.286 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.617 ' HA ' ' HD2' ' A' ' 95' ' ' LYS . 18.8 t70 -58.83 -58.45 8.58 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.102 -0.703 . . . . 74.03 109.102 172.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -67.58 -25.15 65.63 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 113.802 -1.544 . . . . 62.32 111.609 -177.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.431 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.2 t0 -84.51 -42.26 15.71 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.634 0.774 . . . . 75.43 111.898 -172.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.418 ' HG2' ' HG2' ' A' ' 95' ' ' LYS . 9.9 tpt180 -60.06 -42.87 95.44 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.751 0.82 . . . . 74.01 109.13 170.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 30.7 tpt180 -61.79 -43.96 97.82 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 114.409 -1.269 . . . . 73.5 110.773 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.1 -18.08 60.33 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.331 0.653 . . . . 71.04 112.325 -179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.548 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.5 OUTLIER -78.42 -60.81 2.22 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.967 -0.753 . . . . 73.22 108.967 176.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -73.73 -51.27 17.08 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-N 114.803 -1.09 . . . . 70.43 110.866 -171.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 28.4 mmt -101.82 51.74 0.83 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.065 -0.716 . . . . 73.13 109.065 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 5.8 tt -70.61 107.6 3.98 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.152 -0.931 . . . . 73.32 109.443 -176.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -128.08 96.73 4.55 Favored 'General case' 0 C--O 1.243 0.719 0 N-CA-C 107.395 -1.335 . . . . 73.12 107.395 177.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -153.37 -70.1 0.14 Allowed 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 116.49 -0.323 . . . . 75.5 110.877 -173.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -127.25 -59.76 1.22 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 107.744 -1.206 . . . . 64.12 107.744 178.023 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 16.9 m120 58.89 27.53 16.32 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 124.316 1.046 . . . . 62.2 112.044 176.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 CA--C 1.564 1.485 0 C-N-CA 124.497 1.119 . . . . 75.35 110.891 -179.925 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.194 0 CA-C-O 119.751 -0.166 . . . . 72.11 111.332 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -60.15 -43.2 95.92 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.318 0.647 . . . . 62.32 111.247 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -67.76 -38.25 83.2 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.863 -0.608 . . . . 73.22 109.694 -176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.582 HD11 ' HB3' ' A' ' 42' ' ' LEU . 31.6 tp -69.23 -36.52 77.28 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 115.134 -0.939 . . . . 62.41 110.734 176.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.455 ' HG2' ' OE1' ' A' ' 46' ' ' GLN . 3.2 tmtp? -63.6 -42.44 98.23 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 108.612 -0.885 . . . . 73.42 108.612 177.594 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -58.41 -44.74 89.14 Favored 'General case' 0 CA--C 1.548 0.888 0 O-C-N 124.291 0.994 . . . . 70.31 110.765 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.401 HD11 ' HA ' ' A' ' 62' ' ' MET . 82.1 mt -54.31 -50.94 52.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 C-N-CA 124.191 0.996 . . . . 51.1 111.077 174.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.511 HG12 ' O ' ' A' ' 4' ' ' LEU . 24.9 mm -63.27 -43.71 98.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 123.989 0.916 . . . . 71.35 111.02 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 70.8 m -64.15 -48.55 75.57 Favored 'General case' 0 C--N 1.348 0.511 0 O-C-N 123.966 0.791 . . . . 74.41 110.325 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.0 -45.87 86.15 Favored 'General case' 0 C--O 1.208 -1.083 0 O-C-N 124.025 0.828 . . . . 73.43 110.72 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.568 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -59.97 -46.05 94.82 Favored Glycine 0 CA--C 1.532 1.106 0 O-C-N 124.346 1.029 . . . . 24.3 113.027 -178.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -63.38 -49.63 73.07 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 122.56 0.344 . . . . 64.33 110.627 178.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 17' ' ' ARG . 84.3 t -60.84 -33.15 54.2 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.759 0.824 . . . . 73.51 110.932 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.462 HG21 HG21 ' A' ' 35' ' ' VAL . 17.3 mt -57.82 -54.68 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 124.179 0.992 . . . . 72.54 109.007 174.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -62.2 -31.28 71.79 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 124.013 0.82 . . . . 72.01 111.751 -176.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -66.86 -59.95 3.08 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.719 0.407 . . . . 72.11 111.172 175.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.489 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 16.4 ptp180 -73.34 -16.56 61.36 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 112.621 0.6 . . . . 70.34 112.621 -175.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.41 ' SG ' HD23 ' A' ' 31' ' ' LEU . 46.1 t -66.72 -22.83 66.05 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.305 0.642 . . . . 43.43 110.864 173.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -76.34 2.91 12.14 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 60.31 111.836 178.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -86.54 -1.22 57.45 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.536 0.734 . . . . 75.04 111.978 173.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 15.0 mmt -80.81 95.9 6.82 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.912 0.387 . . . . 74.44 110.987 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.647 ' HB3' ' HG2' ' A' ' 82' ' ' ARG . 12.1 tptt -67.97 -41.1 82.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.546 1.138 . . . . 51.3 110.014 170.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -97.17 -178.66 4.26 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 114.979 -1.01 . . . . 72.4 109.225 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 29.9 p 46.68 62.35 2.38 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.768 1.227 . . . . 71.13 111.608 175.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.484 ' HE3' ' O ' ' A' ' 22' ' ' LYS . 32.8 mmtp -73.39 -38.95 65.46 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.58 -1.191 . . . . 65.21 111.742 -173.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 140' ' ' ASP . 58.8 tptt -63.26 -47.67 81.42 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.832 -1.174 . . . . 74.11 107.832 177.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.4 ' HG2' HD12 ' A' ' 97' ' ' LEU . 3.0 tp-100 -46.82 -54.37 10.01 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 125.848 1.659 . . . . 72.43 111.129 175.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 20.4 t -62.17 -50.78 70.47 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.725 1.21 . . . . 63.4 112.88 -178.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -73.6 -37.75 65.33 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.207 0.603 . . . . 74.12 111.8 -171.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -81.15 -28.13 35.19 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 123.304 0.377 . . . . 74.41 110.066 -178.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.41 HD23 ' SG ' ' A' ' 18' ' ' CYS . 69.2 tp -62.26 -51.13 68.98 Favored 'General case' 0 C--N 1.358 0.96 0 N-CA-C 108.262 -1.014 . . . . 65.22 108.262 168.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.1 -36.2 91.98 Favored Glycine 0 C--N 1.348 1.242 0 O-C-N 124.152 0.908 . . . . 60.51 113.089 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 27.5 t-80 -64.49 -53.92 40.61 Favored 'General case' 0 C--O 1.249 1.072 0 C-N-CA 124.031 0.933 . . . . 64.43 110.348 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.1 mtt180 -46.9 -60.69 2.27 Favored 'General case' 0 C--N 1.367 1.362 0 O-C-N 124.992 1.433 . . . . 54.23 109.282 173.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.462 HG21 HG21 ' A' ' 14' ' ' ILE . 48.2 t -57.64 -48.1 84.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 C-N-CA 125.182 1.393 . . . . 74.53 112.596 -171.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.5 mt -65.48 -50.13 66.46 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-N 118.442 0.565 . . . . 61.33 110.726 -177.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.12 -19.66 66.25 Favored Glycine 0 C--N 1.351 1.405 0 O-C-N 123.78 0.675 . . . . 60.22 112.752 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.554 HD11 ' HZ ' ' A' ' 65' ' ' PHE . 19.2 tp -84.46 -50.32 7.86 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.571 1.148 . . . . 73.43 111.974 -178.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.568 HG21 ' HA3' ' A' ' 11' ' ' GLY . 10.1 pt -79.21 -30.95 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.1 0.56 . . . . 63.41 111.221 -171.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 15.4 tppt? -58.68 -53.98 60.85 Favored Pre-proline 0 CA--C 1.567 1.608 0 CA-C-O 118.031 -0.985 . . . . 71.41 113.033 -174.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -61.17 -31.09 89.8 Favored 'Trans proline' 0 C--N 1.391 2.787 0 C-N-CA 121.613 1.542 . . . . 75.03 112.303 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.582 ' HB3' HD11 ' A' ' 4' ' ' LEU . 4.3 mm? -78.03 -36.55 48.45 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.448 0.699 . . . . 74.03 111.24 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HA ' ' A' ' 40' ' ' LYS . 12.0 pt-20 -77.79 -20.34 53.47 Favored 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 119.192 -0.432 . . . . 65.51 111.574 -177.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.0 mmt -60.53 -56.31 22.87 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 123.45 0.469 . . . . 64.02 110.681 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.8 pp -72.64 -30.83 64.64 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.1 0.56 . . . . 75.21 111.437 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.525 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.0 OUTLIER -64.03 -44.61 92.02 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.507 0.723 . . . . 73.24 111.051 175.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.88 -37.2 85.96 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.864 0.866 . . . . 71.24 111.121 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -65.59 -24.66 67.13 Favored 'General case' 0 CA--C 1.544 0.74 0 CA-C-N 114.908 -1.042 . . . . 63.52 110.892 176.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.69 29.01 60.12 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.536 0.522 . . . . 72.01 113.366 172.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -82.28 119.78 24.54 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.779 -0.452 . . . . 53.34 109.779 -177.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 30.2 ttm180 -54.9 -41.88 71.49 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.924 0.89 . . . . 75.3 110.932 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 23.5 m 63.77 -160.44 0.3 Allowed 'General case' 0 N--CA 1.479 0.984 0 O-C-N 124.585 1.178 . . . . 73.15 109.809 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.52 87.24 5.07 Favored Pre-proline 0 CA--C 1.55 0.966 0 N-CA-C 108.208 -1.034 . . . . 75.4 108.208 165.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.576 ' HA ' ' HG ' ' A' ' 58' ' ' LEU . 97.4 Cg_endo -93.26 95.45 0.15 Allowed 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.907 2.404 . . . . 52.13 111.65 176.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.1 m -67.42 -177.52 0.73 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.859 0.864 . . . . 71.3 111.79 178.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -62.67 -37.91 88.26 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.822 0.449 . . . . 72.24 111.011 177.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -67.49 -31.6 71.85 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.334 0.654 . . . . 72.54 111.031 178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' ' 54' ' ' PRO . 4.2 mm? -66.09 -50.74 63.02 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.105 0.562 . . . . 75.42 109.522 174.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 55.0 m -58.39 -48.68 79.85 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.174 0.99 . . . . 72.11 111.228 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.7 m -61.76 -43.97 97.82 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.057 0.943 . . . . 75.45 110.671 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.3 -42.54 98.82 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 123.857 0.723 . . . . 73.25 110.928 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.406 ' SD ' ' HB2' ' A' ' 4' ' ' LEU . 31.2 mmt -64.38 -43.03 95.75 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.507 0.723 . . . . 62.41 110.694 179.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -66.6 -39.57 88.46 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 124.004 0.922 . . . . 72.15 111.3 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.423 ' HE ' HG22 ' A' ' 108' ' ' VAL . 49.7 ttt85 -72.34 -38.07 68.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 125.583 1.553 . . . . 75.31 111.002 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.554 ' HZ ' HD11 ' A' ' 38' ' ' LEU . 2.4 t80 -73.87 -43.77 57.52 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.896 -1.047 . . . . 63.41 109.515 -179.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.487 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.0 ttpp -55.97 -47.42 77.69 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 114.288 -1.323 . . . . 61.35 109.925 172.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.27 -42.87 92.2 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.826 0.85 . . . . 74.41 111.643 -179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.584 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.02 -42.3 98.2 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 115.421 -0.809 . . . . 74.43 110.978 175.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.2 mt -72.02 -26.7 62.32 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.378 0.671 . . . . 72.43 111.852 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 97.8 mt-10 -65.58 -43.81 88.6 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 108.664 -0.865 . . . . 75.44 108.664 175.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.469 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 50.8 mt-10 -61.03 -52.69 63.92 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 114.741 -1.118 . . . . 70.34 110.365 177.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.91 -45.99 82.26 Favored 'General case' 0 N--CA 1.483 1.193 0 O-C-N 124.085 0.866 . . . . 71.55 111.454 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.08 -36.04 80.49 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.513 1.125 . . . . 71.5 110.28 178.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 77' ' ' GLU . . . -69.38 -36.02 77.22 Favored Glycine 0 C--N 1.346 1.124 0 CA-C-N 115.289 -0.869 . . . . 72.02 112.881 174.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 14.4 mm-40 -65.33 -55.41 18.38 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.528 0.664 . . . . 73.03 110.041 -178.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.521 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.2 pt -64.2 -27.06 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.882 0 N-CA-C 112.581 0.586 . . . . 65.54 112.581 176.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.443 ' HB3' ' O ' ' A' ' 74' ' ' GLY . 11.3 tt0 -56.39 -49.13 75.36 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 122.957 0.503 . . . . 72.54 110.669 169.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 mttm -78.03 -28.89 49.15 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.188 0.595 . . . . 60.24 110.968 -177.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.443 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 19.2 m-30 -81.05 -5.8 58.05 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.767 0.827 . . . . 72.24 112.323 -178.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 97.1 p -60.14 -33.06 71.64 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.413 -0.588 . . . . 63.13 109.413 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -82.66 109.13 16.57 Favored 'General case' 0 C--N 1.35 0.59 0 N-CA-C 107.678 -1.23 . . . . 63.34 107.678 165.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.647 ' HG2' ' HB3' ' A' ' 22' ' ' LYS . 3.4 mpt_? -74.53 -25.65 59.47 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.25 0.62 . . . . 61.35 111.645 -172.121 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 13.3 m -62.84 -37.3 86.25 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.839 0.856 . . . . 53.32 110.592 174.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -60.35 -39.22 86.37 Favored 'General case' 0 C--N 1.358 0.943 0 C-N-CA 124.371 1.068 . . . . 75.2 111.072 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 26.0 mt -59.64 -53.96 41.12 Favored 'Isoleucine or valine' 0 C--N 1.364 1.201 0 O-C-N 123.829 0.706 . . . . 65.3 109.653 177.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 16.9 t -62.07 -38.05 87.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.13 0.572 . . . . 72.21 111.717 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.3 tpp180 -59.86 -47.88 83.97 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.389 1.076 . . . . 75.52 110.96 179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -80.81 -22.39 40.07 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 116.15 -0.477 . . . . 75.01 110.555 179.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 17.3 tp -71.81 -41.24 68.48 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.776 0.831 . . . . 62.12 110.717 -173.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -71.22 -21.37 62.14 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 115.896 -0.593 . . . . 74.02 110.565 176.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.75 10.94 32.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.156 0.983 . . . . 55.52 111.058 178.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 35.4 t -70.92 124.38 24.2 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 123.14 0.576 . . . . 74.11 110.718 -174.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -83.34 -7.02 59.64 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 114.757 -1.111 . . . . 64.14 110.381 178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -127.84 -172.51 2.7 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.151 0.981 . . . . 55.43 110.683 -176.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.479 ' HG3' ' HB1' ' A' ' 141' ' ' ALA . 18.6 tptm -108.07 -39.67 5.44 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.772 0.829 . . . . 73.12 109.749 -176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.803 HG13 ' HB2' ' A' ' 141' ' ' ALA . 1.4 mp -87.64 153.17 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.15 -1.055 . . . . 65.31 108.15 -179.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.4 HD12 ' HG2' ' A' ' 27' ' ' GLN . 26.3 mt -76.93 -46.84 22.82 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.909 0.862 . . . . 74.01 108.792 174.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.521 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 13.8 m-85 -98.51 34.6 1.98 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.152 -1.386 . . . . 73.52 110.455 -176.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.663 ' HG3' HD13 ' A' ' 96' ' ' ILE . 22.1 ttpt -52.58 -65.2 0.6 Allowed 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.735 0.698 . . . . 74.55 112.058 -172.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -65.92 -47.85 73.39 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.82 0.7 . . . . 74.54 110.558 -173.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 84.4 t -60.7 -57.82 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 124.287 0.992 . . . . 72.0 111.951 -176.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -72.32 -24.16 61.27 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.811 0.844 . . . . 75.15 111.273 -174.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 8.5 ttm180 -66.94 -35.9 81.03 Favored 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 109.95 -0.389 . . . . 74.14 109.95 168.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 108' ' ' VAL . 60.1 mtpt -69.67 -37.81 76.83 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 119.113 -0.47 . . . . 63.12 110.64 172.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.584 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.9 mp -55.61 -45.2 77.54 Favored 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 109.553 -0.536 . . . . 74.2 109.553 171.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 t -63.11 -53.86 46.9 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 124.127 0.892 . . . . 42.14 110.885 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -60.7 -52.92 63.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.549 1.14 . . . . 70.43 111.508 -174.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.423 HG22 ' HE ' ' A' ' 64' ' ' ARG . 59.1 t -63.02 -42.97 98.69 Favored 'Isoleucine or valine' 0 C--N 1.344 0.346 0 O-C-N 124.07 0.856 . . . . 73.12 110.345 -178.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.404 ' HE1' HD13 ' A' ' 127' ' ' ILE . 25.8 t-105 -61.76 -35.24 77.55 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.374 0.422 . . . . 73.33 111.403 177.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 57.6 mtpt -61.24 -55.35 32.99 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 109.712 -0.477 . . . . 74.14 109.712 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -56.1 -41.48 75.31 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.007 0.923 . . . . 73.53 111.05 178.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 3.7 tt -75.0 -47.78 27.42 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-N 114.115 -1.402 . . . . 72.04 110.45 -170.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.3 p -65.22 -33.41 75.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.222 0.609 . . . . 63.43 110.541 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.44 ' O ' HG23 ' A' ' 118' ' ' VAL . 80.0 mt -60.21 -57.13 14.12 Favored 'General case' 0 C--N 1.358 0.939 0 O-C-N 123.892 0.745 . . . . 71.21 110.453 172.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.1 pp -65.12 -23.77 67.23 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 111.801 0.297 . . . . 71.4 111.801 -178.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 83.7 mt -70.28 -45.58 66.06 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 109.876 -0.416 . . . . 72.34 109.876 171.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.424 ' O ' ' HA ' ' A' ' 121' ' ' ARG . 30.0 tt0 -77.13 -19.71 56.54 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.611 0.764 . . . . 61.11 111.185 -174.312 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 114' ' ' LEU . 64.1 t -91.36 -56.42 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 122.947 0.499 . . . . 74.34 110.288 177.17 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -73.51 -59.13 2.86 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 121.082 0.468 . . . . 71.44 110.736 -175.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -84.93 -16.43 41.1 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.588 -0.733 . . . . 72.33 110.767 -175.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 60.4 mtm-85 57.14 44.16 22.86 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.443 1.097 . . . . 54.24 110.013 -175.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.464 ' SD ' HD13 ' A' ' 116' ' ' LEU . 44.7 ttm -70.86 127.42 91.79 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 114.637 -1.165 . . . . 70.23 111.081 -174.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 122' ' ' MET . 6.3 Cg_exo -77.24 93.89 1.07 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.729 2.286 . . . . 64.33 109.846 170.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 7.2 p -144.84 113.25 1.54 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 CA-C-O 121.327 0.584 . . . . 61.24 110.636 -178.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 32.4 t -164.83 73.7 1.5 Allowed Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.141 0.976 . . . . 24.1 108.982 168.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -87.08 -3.21 7.98 Favored 'Trans proline' 0 C--N 1.374 1.874 0 C-N-CA 122.838 2.358 . . . . 74.53 111.992 172.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.404 HD13 ' HE1' ' A' ' 109' ' ' TRP . 30.0 pt -97.16 153.37 3.82 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 C-N-CA 123.893 0.877 . . . . 60.34 109.239 -176.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 25.1 m -74.49 78.09 1.94 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.409 0.683 . . . . 54.44 110.233 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 72.0 -62.78 0.45 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 125.217 1.407 . . . . 72.54 112.963 -177.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.03 -19.01 7.85 Favored Glycine 0 C--N 1.338 0.64 0 N-CA-C 110.982 -0.847 . . . . 54.03 110.982 -167.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -74.75 -46.73 35.32 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.727 0.811 . . . . 75.15 110.585 177.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 59.5 p -71.96 -14.12 61.82 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.26 -0.882 . . . . 74.33 111.412 178.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -20.45 64.89 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.822 0.849 . . . . 74.32 112.292 175.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -84.0 -34.08 24.4 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.0 0.52 . . . . 61.5 111.492 171.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -80.0 -33.05 39.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.897 0.879 . . . . 72.41 111.584 -173.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -59.88 -37.54 79.65 Favored 'General case' 0 C--N 1.353 0.746 0 O-C-N 123.492 0.495 . . . . 63.51 109.825 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -60.87 -37.71 83.06 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 124.628 1.171 . . . . 75.35 111.573 177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.1 tt0 -68.84 -50.31 51.1 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 123.265 0.353 . . . . 73.03 111.287 179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -60.1 -42.02 93.78 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 123.806 0.691 . . . . 74.02 110.481 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.468 ' HA ' ' HG2' ' A' ' 26' ' ' LYS . 1.4 t70 -60.7 -54.1 49.36 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.052 1.741 . . . . 63.02 110.918 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.803 ' HB2' HG13 ' A' ' 96' ' ' ILE . . . -53.98 -53.02 58.61 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.13 -1.396 . . . . 51.04 112.067 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -57.57 -45.33 85.32 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.1 -1.409 . . . . 73.32 111.114 179.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.418 ' HG2' HH12 ' A' ' 153' ' ' ARG . 25.0 tt0 -64.22 -52.47 58.63 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 124.728 1.268 . . . . 53.21 111.159 -172.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -72.51 -38.01 68.21 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 124.022 0.826 . . . . 63.45 111.725 -174.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.48 ' O ' ' HG2' ' A' ' 149' ' ' GLN . 0.0 OUTLIER -57.41 -50.23 73.68 Favored 'General case' 0 N--CA 1.474 0.768 0 O-C-N 123.498 0.499 . . . . 62.11 109.891 174.195 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.415 ' N ' ' HD3' ' A' ' 145' ' ' ARG . 5.7 tmm_? -71.47 -31.19 66.86 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.501 0.72 . . . . 63.45 110.035 -176.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -78.2 -19.83 53.09 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.189 0.596 . . . . 52.43 111.675 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -80.42 -50.94 9.43 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 108.772 -0.825 . . . . 75.15 108.772 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 145' ' ' ARG . 25.1 mm-40 -60.82 -60.19 4.19 Favored 'General case' 0 N--CA 1.481 1.107 0 O-C-N 123.902 0.752 . . . . 63.21 109.581 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 5.9 mmt -99.8 66.67 1.41 Allowed 'General case' 0 C--O 1.244 0.787 0 C-N-CA 124.361 1.064 . . . . 52.33 109.071 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp -75.52 85.88 2.61 Favored 'General case' 0 C--N 1.351 0.672 0 CA-C-O 121.986 0.898 . . . . 53.54 109.864 179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 89.2 mtt180 -109.7 -9.83 14.83 Favored 'General case' 0 N--CA 1.474 0.753 0 CA-C-N 115.026 -0.988 . . . . 71.1 109.646 174.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.418 HH12 ' HG2' ' A' ' 143' ' ' GLU . 97.0 mtt180 -63.75 -28.48 69.91 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.23 1.012 . . . . 71.4 110.593 170.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -117.57 -66.49 1.07 Allowed 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.727 0.811 . . . . 74.21 109.951 170.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 7.0 t30 58.13 89.28 0.05 Allowed 'General case' 0 N--CA 1.48 1.053 0 O-C-N 124.332 1.02 . . . . 74.05 110.311 -173.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 . . . . . 0 CA--C 1.555 1.17 0 C-N-CA 123.676 0.791 . . . . 64.24 109.507 -173.61 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.8 ttp . . . . . 0 N--CA 1.483 1.201 0 N-CA-C 109.971 -0.381 . . . . 75.13 109.971 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -58.23 -50.48 73.43 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.139 0.976 . . . . 64.31 110.964 -177.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -68.88 -36.75 78.47 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 116.023 -0.535 . . . . 71.35 111.265 -176.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.453 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.1 mm? -62.97 -47.26 83.96 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.544 0.337 . . . . 62.41 110.519 174.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.503 ' HA ' ' NE2' ' A' ' 46' ' ' GLN . 51.8 tptt -57.42 -43.27 83.67 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.309 0.644 . . . . 72.41 109.829 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 9.6 m-70 -61.57 -63.98 1.09 Allowed 'General case' 0 C--O 1.204 -1.331 0 CA-C-O 118.385 -0.816 . . . . 72.32 111.085 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.0 mt -47.98 -45.59 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 124.094 0.958 . . . . 71.31 112.917 -174.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -70.92 -48.55 55.73 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.022 0 CA-C-N 115.647 -0.706 . . . . 44.15 110.987 -177.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.1 m -61.62 -48.55 80.37 Favored 'General case' 0 N--CA 1.482 1.141 0 O-C-N 123.179 0.299 . . . . 74.1 110.305 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -57.19 -45.02 84.11 Favored 'General case' 0 C--O 1.208 -1.118 0 C-N-CA 124.648 1.179 . . . . 55.32 110.949 -179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.431 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -63.15 -42.29 99.49 Favored Glycine 0 C--N 1.347 1.167 0 O-C-N 124.244 0.965 . . . . 72.43 113.075 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 25.4 mt-30 -65.13 -43.24 92.58 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.198 0.599 . . . . 62.13 111.753 176.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.5 t -76.03 -25.29 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.619 0.767 . . . . 62.03 110.541 -178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 8.6 mt -65.46 -51.77 59.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.841 0.856 . . . . 74.11 108.877 171.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -61.32 -36.54 80.43 Favored 'General case' 0 CA--C 1.543 0.708 0 O-C-N 124.12 0.888 . . . . 74.3 110.335 -179.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -56.02 19.95 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.428 1.091 . . . . 74.21 110.56 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.491 ' HD2' HG13 ' A' ' 76' ' ' ILE . 5.2 ptp180 -75.84 -16.28 60.1 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-N 115.679 -0.691 . . . . 72.13 111.723 -178.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.572 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 48.2 t -72.15 -21.53 61.44 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.29 0.636 . . . . 70.24 110.54 172.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -81.18 0.01 38.4 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.502 0.721 . . . . 74.45 111.979 175.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -65.5 -29.73 70.41 Favored 'General case' 0 N--CA 1.481 1.104 0 N-CA-C 109.457 -0.572 . . . . 55.41 109.457 165.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 5.1 mmt -71.15 89.57 0.85 Allowed 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 116.066 -0.516 . . . . 72.12 109.623 -178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -75.25 -27.21 59.37 Favored 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 108.496 -0.927 . . . . 72.32 108.496 170.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -93.33 172.32 8.36 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.597 1.159 . . . . 60.31 108.319 163.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.461 ' SG ' ' HD2' ' A' ' 148' ' ' PHE . 28.5 m 51.93 48.69 22.27 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.275 0.56 . . . . 53.25 110.878 -176.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.424 ' O ' ' HD3' ' A' ' 29' ' ' ARG . 94.5 mttt -63.78 -41.04 98.02 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.047 -0.978 . . . . 72.13 111.035 -173.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 0.5 OUTLIER -75.97 -22.92 55.4 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-N 115.958 -0.565 . . . . 54.33 109.735 -176.84 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.608 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 11.7 mm-40 -69.47 -40.56 77.02 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 123.005 0.522 . . . . 75.13 110.665 168.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.572 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 41.9 t -59.25 -42.63 91.55 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.359 0.663 . . . . 73.21 110.001 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.424 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 11.5 mpt_? -77.12 -30.31 55.16 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 115.429 -0.805 . . . . 74.44 111.859 178.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.6 ttp85 -71.39 -60.03 2.45 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.369 0.668 . . . . 63.02 110.453 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 18' ' ' CYS . 46.9 tp -56.61 -43.8 80.51 Favored 'General case' 0 C--N 1.354 0.774 0 CA-C-N 114.714 -1.13 . . . . 73.22 109.978 174.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.09 -49.12 74.27 Favored Glycine 0 C--N 1.352 1.462 0 O-C-N 124.103 0.877 . . . . 72.51 113.192 177.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 49.7 t-80 -60.95 -47.76 84.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.811 0.845 . . . . 73.43 110.903 -177.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.468 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 31.5 mtt180 -60.59 -60.33 3.98 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 124.093 0.871 . . . . 72.21 111.286 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.7 t -54.91 -45.07 75.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 O-C-N 124.306 1.004 . . . . 63.44 111.528 -175.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.49 -44.16 97.57 Favored 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.623 0.577 . . . . 74.51 110.752 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.09 -25.82 71.14 Favored Glycine 0 CA--C 1.537 1.412 0 O-C-N 123.517 0.511 . . . . 62.13 113.521 177.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 40.8 mt -79.96 -49.8 11.34 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.385 0.674 . . . . 74.13 110.983 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 10.5 pt -74.43 -33.69 33.98 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 CA-C-O 118.372 -0.823 . . . . 73.44 111.224 -175.515 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -44.53 -58.61 4.95 Favored Pre-proline 0 N--CA 1.503 2.2 0 C-N-CA 124.914 1.286 . . . . 65.44 113.87 -170.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.46 ' HG2' HD22 ' A' ' 42' ' ' LEU . 35.0 Cg_endo -62.72 -42.05 27.69 Favored 'Trans proline' 0 C--N 1.401 3.338 0 C-N-CA 121.383 1.389 . . . . 75.34 110.692 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.6 mm? -70.11 -20.2 63.2 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.571 0.748 . . . . 63.4 111.499 -177.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' HG23 ' A' ' 8' ' ' ILE . 63.7 mt-10 -73.62 -45.31 53.77 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.796 0.839 . . . . 73.02 109.561 175.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.4 mmt -62.4 -33.18 74.27 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 115.659 -0.7 . . . . 70.12 110.802 174.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 43.8 mt -82.09 -21.06 36.97 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.007 0.923 . . . . 32.33 111.847 178.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' A' ' 5' ' ' LYS . 33.5 tt0 -75.27 -38.11 60.6 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.765 0.426 . . . . 55.15 110.042 173.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -64.4 -30.86 71.89 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.391 0.677 . . . . 71.04 110.407 176.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -98.91 2.18 46.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.005 0.922 . . . . 73.33 111.576 174.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -69.64 135.4 26.82 Favored Glycine 0 C--N 1.343 0.963 0 O-C-N 123.483 0.489 . . . . 71.22 112.614 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.02 -173.12 4.39 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.564 0.745 . . . . 63.11 109.068 -176.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -63.62 90.14 0.05 Allowed 'General case' 0 C--N 1.352 0.7 0 C-N-CA 123.522 0.729 . . . . 75.23 109.521 174.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 20.0 m -104.08 170.38 7.94 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 114.381 -1.281 . . . . 73.23 108.575 176.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.9 t -113.4 90.76 17.97 Favored Pre-proline 0 CA--C 1.551 0.985 0 N-CA-C 108.615 -0.883 . . . . 62.12 108.615 177.162 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -84.81 150.31 11.18 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.666 2.244 . . . . 73.3 112.327 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m -73.52 163.39 28.1 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 122.917 0.487 . . . . 73.54 110.389 174.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -66.47 -32.14 73.32 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 110.168 -0.308 . . . . 72.11 110.168 178.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -71.77 -30.87 66.03 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 122.487 0.315 . . . . 74.31 111.132 175.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -67.1 -51.21 57.08 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 107.883 -1.155 . . . . 73.44 107.883 176.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 90.1 m -58.06 -47.59 82.69 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 124.454 1.102 . . . . 75.14 111.198 177.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 95.4 m -65.88 -40.9 92.04 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.768 0.827 . . . . 70.33 111.14 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -64.48 -41.68 96.34 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.803 0.441 . . . . 70.01 110.283 177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 25.0 mmt -69.51 -26.67 64.65 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.105 0.562 . . . . 55.22 111.261 176.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.51 ' HA ' ' HE2' ' A' ' 66' ' ' LYS . 84.8 m-20 -76.44 -38.28 55.73 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.466 0.706 . . . . 73.34 110.632 176.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -69.19 -39.51 78.64 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.737 0.815 . . . . 74.11 109.811 178.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.422 ' O ' ' HG ' ' A' ' 69' ' ' LEU . 0.6 OUTLIER -67.62 -49.0 65.17 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.286 1.034 . . . . 72.24 109.014 -177.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HE2' ' HA ' ' A' ' 63' ' ' ASN . 37.1 ttpt -55.59 -46.1 77.3 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.054 1.342 . . . . 74.13 111.754 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' A' ' 71' ' ' GLU . . . -70.56 -32.22 69.55 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.463 0.705 . . . . 75.11 111.454 -177.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -71.02 -32.43 69.21 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 123.356 0.662 . . . . 72.12 109.885 175.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 65' ' ' PHE . 95.1 mt -73.11 -27.59 61.78 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.595 -0.73 . . . . 60.14 110.502 173.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -66.55 -41.78 88.16 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 122.777 0.431 . . . . 74.03 110.637 171.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.43 ' HB2' HG13 ' A' ' 101' ' ' VAL . 16.5 mm-40 -60.58 -49.29 78.13 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 123.63 0.581 . . . . 64.13 109.977 175.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.506 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.18 -46.8 88.47 Favored 'General case' 0 C--N 1.354 0.773 0 O-C-N 123.9 0.75 . . . . 73.42 111.264 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.8 t30 -56.19 -47.53 78.16 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.5 1.12 . . . . 74.23 110.599 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.73 -37.73 94.72 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.083 -0.962 . . . . 63.2 112.878 -179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -61.46 -53.07 61.3 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.0 0.52 . . . . 71.42 110.978 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.568 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -69.12 -20.31 24.42 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.259 0 N-CA-C 112.239 0.459 . . . . 72.04 112.239 179.305 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -67.26 -41.03 86.22 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.262 0.553 . . . . 64.01 111.055 168.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 35.5 ttpt -71.97 -30.23 65.06 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 115.127 -0.942 . . . . 73.42 110.816 175.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.522 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.4 m-85 -83.97 -8.17 59.22 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.741 0.817 . . . . 72.31 112.271 -179.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 9.1 t -61.9 -22.11 65.3 Favored 'General case' 0 CA--C 1.556 1.206 0 CA-C-O 121.241 0.543 . . . . 73.45 110.291 176.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -86.05 108.55 18.31 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 108.212 -1.033 . . . . 64.43 108.212 160.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -75.54 -23.84 56.67 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 122.864 0.465 . . . . 74.35 110.595 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.1 m -67.9 -35.0 77.72 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.131 0.572 . . . . 74.42 110.58 172.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -64.07 -38.3 90.58 Favored 'General case' 0 C--O 1.25 1.11 0 C-N-CA 123.209 0.604 . . . . 73.33 110.096 175.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.497 HG23 HD11 ' A' ' 97' ' ' LEU . 32.8 mt -59.81 -56.73 15.42 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.226 0 O-C-N 123.816 0.698 . . . . 72.32 109.177 174.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 24.1 t -56.54 -38.22 71.56 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.361 0.664 . . . . 71.23 111.762 -176.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 31.1 ttm180 -56.05 -59.18 5.28 Favored 'General case' 0 C--N 1.353 0.76 0 O-C-N 124.664 1.228 . . . . 75.51 111.028 176.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -75.75 -25.6 56.67 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 116.058 -0.519 . . . . 75.42 110.206 -175.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.46 HD23 HE21 ' A' ' 149' ' ' GLN . 16.6 tp -74.13 -41.33 61.75 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.547 0.739 . . . . 74.51 110.03 -169.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 12.0 t -66.17 -22.76 66.37 Favored 'General case' 0 CA--C 1.551 1.007 0 O-C-N 123.434 0.459 . . . . 73.4 110.598 176.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.62 -28.91 19.2 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.056 0.943 . . . . 64.04 111.546 177.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 79.4 p -81.16 102.78 10.52 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 122.917 0.487 . . . . 71.04 111.34 -174.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -74.52 -1.37 21.04 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.491 0.716 . . . . 71.14 110.885 171.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -65.27 -39.97 93.29 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.175 0.99 . . . . 64.52 110.912 175.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 142' ' ' ASP . 0.0 OUTLIER 74.36 -53.05 0.68 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 126.289 1.835 . . . . 73.44 111.548 -170.071 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.462 ' H ' HD12 ' A' ' 96' ' ' ILE . 3.0 mp -67.56 116.29 6.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.664 -0.865 . . . . 55.34 108.664 -177.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.608 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 9.3 tp -56.48 -30.37 62.87 Favored 'General case' 0 N--CA 1.478 0.957 0 O-C-N 124.329 1.018 . . . . 62.11 112.074 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.568 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 28.1 m-85 -121.57 26.94 8.5 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 114.616 -1.174 . . . . 72.32 111.716 -173.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.7 tmtm? -40.03 -63.71 0.58 Allowed 'General case' 0 N--CA 1.502 2.133 0 C-N-CA 124.398 1.079 . . . . 71.5 112.183 -169.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -58.48 -61.55 2.51 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.581 1.152 . . . . 72.13 111.86 -178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.43 HG13 ' HB2' ' A' ' 71' ' ' GLU . 96.9 t -59.79 -56.32 18.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.681 1.192 . . . . 72.21 111.685 -172.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.483 ' HB2' ' HB3' ' A' ' 98' ' ' PHE . 50.7 t30 -61.07 -33.63 73.64 Favored 'General case' 0 C--O 1.245 0.864 0 C-N-CA 124.926 1.29 . . . . 74.33 112.517 -178.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.58 -41.36 97.31 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 109.47 -0.567 . . . . 65.53 109.47 172.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 91.5 mttt -68.85 -31.9 71.19 Favored 'General case' 0 N--CA 1.48 1.041 0 CA-C-N 115.786 -0.643 . . . . 73.44 112.442 176.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.81 -49.36 78.0 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 109.533 -0.543 . . . . 73.51 109.533 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.7 t -66.51 -32.77 74.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.806 0.842 . . . . 72.45 111.52 -179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 15.0 t70 -70.19 -51.39 31.47 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.656 0.783 . . . . 74.32 110.433 -178.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.5 -27.67 37.38 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-N 116.042 -0.526 . . . . 73.1 110.337 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 48.5 t-105 -69.42 -37.15 77.3 Favored 'General case' 0 C--N 1.35 0.596 0 C-N-CA 122.804 0.442 . . . . 75.34 111.462 174.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 32.5 pttt -66.49 -40.04 89.07 Favored 'General case' 0 CA--C 1.552 1.032 0 N-CA-C 108.217 -1.031 . . . . 74.21 108.217 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 42.0 mt-10 -60.56 -47.96 83.87 Favored 'General case' 0 C--N 1.372 1.547 0 O-C-N 123.526 0.516 . . . . 74.34 110.41 174.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.403 HD12 ' HB1' ' A' ' 61' ' ' ALA . 0.2 OUTLIER -56.51 -61.36 2.46 Favored 'General case' 0 C--N 1.352 0.716 0 O-C-N 124.842 1.339 . . . . 63.21 108.718 -177.599 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 40.4 t -49.26 -43.41 42.92 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.03 1.332 . . . . 52.45 111.274 -178.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.419 ' O ' HG23 ' A' ' 118' ' ' VAL . 57.4 mt -58.3 -66.15 0.53 Allowed 'General case' 0 C--N 1.364 1.205 0 O-C-N 123.832 0.708 . . . . 74.43 111.896 175.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.9 pp -62.93 -27.68 69.55 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 112.241 0.46 . . . . 64.43 112.241 -172.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.46 ' HB3' ' HE3' ' A' ' 122' ' ' MET . 95.1 mt -70.69 -48.36 55.11 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 124.067 0.947 . . . . 73.44 110.673 176.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -78.83 -20.68 49.06 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 122.508 0.323 . . . . 74.13 111.644 -175.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.419 HG23 ' O ' ' A' ' 114' ' ' LEU . 98.1 t -81.1 -55.38 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 110.014 -0.365 . . . . 60.42 110.014 177.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -87.56 -58.52 2.55 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 111.729 0.27 . . . . 54.42 111.729 -173.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -76.81 -8.02 56.53 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.417 0.287 . . . . 74.52 111.239 -179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 58.31 32.88 22.6 Favored 'General case' 0 C--N 1.36 1.027 0 C-N-CA 124.621 1.168 . . . . 72.21 111.243 177.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.46 ' HE3' ' HB3' ' A' ' 116' ' ' LEU . 35.0 ttm -72.24 124.92 91.47 Favored Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 114.93 -1.032 . . . . 75.12 110.921 -174.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -80.46 79.61 3.28 Favored 'Trans proline' 0 C--N 1.367 1.533 0 C-N-CA 122.463 2.109 . . . . 74.53 110.984 178.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.409 HG21 ' HG3' ' A' ' 41' ' ' PRO . 12.9 p -145.16 112.8 1.36 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.834 0 CA-C-N 115.595 -0.729 . . . . 74.34 110.158 177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.3 t -169.78 71.2 0.65 Allowed Pre-proline 0 CA--C 1.544 0.742 0 C-N-CA 124.62 1.168 . . . . 54.43 108.448 171.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -88.78 32.06 0.39 Allowed 'Trans proline' 0 C--N 1.374 1.885 0 C-N-CA 123.019 2.48 . . . . 74.12 110.959 176.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 9.8 tt -154.3 -38.75 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.242 0.698 0 C-N-CA 124.347 1.059 . . . . 63.21 109.975 -164.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 22.9 m 65.48 -76.56 0.04 OUTLIER 'General case' 0 C--N 1.359 0.998 0 C-N-CA 125.418 1.487 . . . . 51.12 111.885 -176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.1 20.55 1.93 Allowed 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 122.932 0.493 . . . . 72.14 109.873 -178.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 78.1 36.74 30.71 Favored Glycine 0 C--N 1.343 0.954 0 O-C-N 122.097 -0.377 . . . . 54.24 113.047 179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.33 -55.44 24.59 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.387 0.675 . . . . 62.21 110.809 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.413 ' O ' ' HG2' ' A' ' 136' ' ' GLU . 20.7 m -72.39 -42.2 65.47 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.679 -0.691 . . . . 71.32 110.577 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.419 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.7 m0 -56.29 -25.21 47.53 Favored 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 114.258 1.207 . . . . 75.32 114.258 -170.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -77.44 -39.48 46.67 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.672 0.272 . . . . 55.31 110.981 175.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -67.37 -47.73 69.51 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.656 0.782 . . . . 74.01 110.181 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 132' ' ' SER . 13.7 mm-40 -57.45 -63.04 1.37 Allowed 'General case' 0 C--N 1.355 0.809 0 CA-C-N 114.412 -1.267 . . . . 73.15 110.636 -170.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -56.21 -38.66 71.31 Favored 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.736 1.272 . . . . 74.21 112.66 -176.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.417 ' HA ' HD11 ' A' ' 96' ' ' ILE . 6.4 tp-100 -58.18 -60.42 3.78 Favored 'General case' 0 CA--C 1.547 0.836 0 O-C-N 124.085 0.865 . . . . 75.42 110.43 178.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -68.73 -39.63 80.27 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.562 -0.745 . . . . 73.1 111.362 -175.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -57.93 -57.98 10.41 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 125.929 1.692 . . . . 72.51 110.029 -177.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.404 ' HA ' HE22 ' A' ' 27' ' ' GLN . . . -75.29 -25.03 57.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 114.226 -1.352 . . . . 74.12 112.252 -174.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 95' ' ' LYS . 22.0 t70 -61.09 -56.05 25.38 Favored 'General case' 0 C--N 1.349 0.58 0 O-C-N 123.724 0.64 . . . . 72.11 109.315 172.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.84 -33.36 75.8 Favored 'General case' 0 N--CA 1.474 0.769 0 O-C-N 124.488 1.117 . . . . 74.3 111.695 -177.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.531 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 25.5 t0 -74.15 -32.63 63.22 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 123.197 0.311 . . . . 74.23 111.114 179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 35.7 ttt-85 -67.07 -37.05 83.31 Favored 'General case' 0 C--N 1.355 0.81 0 N-CA-C 109.222 -0.658 . . . . 73.44 109.222 173.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.471 ' HG2' ' O ' ' A' ' 142' ' ' ASP . 10.8 mmt180 -63.77 -44.1 94.42 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 109.558 -0.534 . . . . 73.53 109.558 174.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.51 -32.93 74.59 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.716 0.806 . . . . 72.33 111.862 -176.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.461 ' HD2' ' SG ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER -76.47 -61.65 1.89 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 109.842 -0.429 . . . . 65.01 109.842 178.926 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . 0.46 HE21 HD23 ' A' ' 89' ' ' LEU . 86.7 mm-40 -68.82 -33.04 73.18 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.62 0.768 . . . . 73.25 111.173 -170.532 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.9 ttm -117.18 80.28 1.46 Allowed 'General case' 0 C--O 1.239 0.501 0 N-CA-C 107.537 -1.282 . . . . 45.2 107.537 171.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.535 HD11 ' HA ' ' A' ' 155' ' ' ASN . 26.1 tp -84.36 69.12 10.45 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 122.115 0.96 . . . . 71.45 108.479 176.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -118.78 48.6 1.43 Allowed 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 105.883 -1.895 . . . . 72.1 105.883 175.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -125.62 4.22 7.53 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 113.558 -1.656 . . . . 71.11 109.081 -177.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 55.46 27.98 10.97 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.392 1.077 . . . . 63.32 111.416 -169.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.535 ' HA ' HD11 ' A' ' 151' ' ' LEU . 5.9 t30 74.36 -25.88 0.2 Allowed 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 125.04 1.336 . . . . 73.33 114.245 171.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 . . . . . 0 CA--C 1.559 1.316 0 C-N-CA 125.226 1.411 . . . . 72.31 110.614 -170.134 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.9 ttp . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.555 0.693 . . . . 73.51 109.501 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -66.85 -44.06 82.0 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.74 0.816 . . . . 61.4 110.583 -173.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.548 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 59.9 m-20 -56.38 -53.86 52.39 Favored 'General case' 0 C--O 1.215 -0.751 0 O-C-N 124.059 0.85 . . . . 74.03 110.784 175.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 42.7 mt -56.57 -46.36 80.82 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 123.999 0.812 . . . . 74.03 111.804 -178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -54.79 -47.61 73.77 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.618 0.574 . . . . 73.41 110.707 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -69.46 -42.17 75.24 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 118.826 -0.607 . . . . 75.35 112.415 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 96.0 mt -64.08 -43.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 C-N-CA 123.829 0.852 . . . . 62.22 110.514 -177.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 29.5 mm -67.69 -42.84 86.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.029 -0.987 . . . . 61.4 110.471 -179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 98.2 m -60.68 -48.98 79.34 Favored 'General case' 0 C--N 1.357 0.91 0 O-C-N 123.523 0.515 . . . . 61.33 110.539 175.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.9 mt -55.12 -49.97 70.42 Favored 'General case' 0 C--O 1.209 -1.069 0 C-N-CA 123.995 0.918 . . . . 75.31 110.119 178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.96 -48.45 79.01 Favored Glycine 0 C--N 1.343 0.92 0 O-C-N 124.844 1.34 . . . . 74.24 112.973 -178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.412 ' O ' ' HG2' ' A' ' 16' ' ' LYS . 79.1 mt-30 -62.44 -49.38 75.68 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 122.799 0.44 . . . . 73.03 111.284 179.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 89.6 t -61.9 -34.92 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.891 0.877 . . . . 62.3 110.764 178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.473 HD11 ' O ' ' A' ' 69' ' ' LEU . 8.6 mt -62.92 -48.27 88.82 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 124.824 1.25 . . . . 71.2 110.505 177.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.4 t-80 -62.76 -36.58 83.51 Favored 'General case' 0 CA--C 1.541 0.627 0 O-C-N 123.994 0.809 . . . . 63.23 110.355 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 12' ' ' GLN . 29.8 mmmt -66.24 -48.17 71.4 Favored 'General case' 0 CA--C 1.544 0.73 0 O-C-N 123.669 0.605 . . . . 62.21 112.083 178.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -77.66 -17.99 57.16 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.346 0.258 . . . . 73.43 111.646 -179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' SG ' HD23 ' A' ' 31' ' ' LEU . 53.0 t -71.33 -22.24 61.94 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.58 0.752 . . . . 71.44 111.031 173.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -66.48 -16.69 64.31 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.722 0.409 . . . . 73.43 111.3 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -68.62 -17.18 64.06 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.124 0.57 . . . . 74.32 112.325 174.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.494 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 5.7 mmt -76.74 83.29 3.35 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 109.596 -0.52 . . . . 72.22 109.596 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -40.97 72.75 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 107.703 -1.221 . . . . 73.43 107.703 174.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.2 m-85 -92.77 154.53 18.23 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 114.239 -1.346 . . . . 73.32 108.543 170.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 144' ' ' ASP . 80.9 m 58.97 58.83 3.02 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-O 121.977 0.894 . . . . 50.25 109.344 -171.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -73.36 -34.39 65.58 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 114.199 -1.364 . . . . 71.52 111.472 -169.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 5.0 mtpm? -81.74 -27.66 33.72 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 109.047 -0.723 . . . . 52.21 109.047 -177.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.661 ' HG3' ' HG ' ' A' ' 97' ' ' LEU . 27.4 mm-40 -61.28 -40.65 94.92 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.423 0.689 . . . . 65.12 110.537 165.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 42.5 t -65.55 -36.17 83.0 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.692 0.797 . . . . 51.53 110.982 176.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -71.97 -31.95 66.78 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.207 0.603 . . . . 60.24 110.92 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.483 ' CZ ' ' HB3' ' A' ' 136' ' ' GLU . 21.5 mmt180 -69.14 -52.33 29.22 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.782 0.433 . . . . 64.05 110.373 178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.442 HD23 ' SG ' ' A' ' 18' ' ' CYS . 29.7 tp -65.3 -38.85 91.49 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 123.62 0.575 . . . . 71.53 110.243 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.87 -54.41 38.2 Favored Glycine 0 C--N 1.346 1.111 0 O-C-N 123.691 0.619 . . . . 73.25 112.915 177.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 -64.6 -44.37 90.83 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.848 0.859 . . . . 71.13 110.781 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.492 ' HG2' ' CE2' ' A' ' 133' ' ' TRP . 39.5 mtm180 -57.78 -60.6 3.45 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 124.084 0.865 . . . . 73.02 110.406 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.9 t -58.09 -51.58 69.08 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.576 0 O-C-N 124.311 1.007 . . . . 50.1 112.1 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 91.2 mt -60.6 -45.65 93.21 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-N 118.064 0.393 . . . . 74.42 111.01 -177.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -73.18 -18.36 79.19 Favored Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.943 -0.571 . . . . 71.42 113.448 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' ARG . 12.6 tp -87.35 -40.01 14.82 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.52 0.728 . . . . 75.42 111.124 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.415 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 11.8 pt -79.73 -34.56 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 CA-C-O 119.058 -0.496 . . . . 74.33 110.361 -177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 11.6 tppt? -53.68 -50.64 82.34 Favored Pre-proline 0 CA--C 1.562 1.414 0 CA-C-O 117.929 -1.034 . . . . 75.02 113.415 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.64 -39.84 78.96 Favored 'Trans proline' 0 C--N 1.4 3.265 0 C-N-CA 121.699 1.6 . . . . 74.44 112.265 177.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 45' ' ' LEU . 4.0 mm? -69.48 -31.99 70.61 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 115.62 -0.718 . . . . 61.52 111.072 -179.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 52.6 mt-10 -70.31 -38.9 75.05 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.065 0.546 . . . . 73.23 111.153 176.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.0 mtm -61.77 -46.13 90.92 Favored 'General case' 0 N--CA 1.481 1.104 0 O-C-N 123.625 0.578 . . . . 53.03 111.47 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.677 HD21 HD13 ' A' ' 42' ' ' LEU . 3.7 pp -75.25 -33.06 61.25 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 116.323 -0.399 . . . . 75.23 111.007 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.7 -32.95 74.6 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.148 0.579 . . . . 74.22 110.572 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -72.65 -45.37 59.28 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.936 0.894 . . . . 74.41 111.902 -179.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -100.53 -51.67 3.55 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 111.91 0.337 . . . . 71.45 111.91 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -84.89 70.77 3.07 Favored Glycine 0 C--N 1.345 1.042 0 N-CA-C 111.971 -0.452 . . . . 72.33 111.971 -176.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.0 tptp -84.66 65.67 9.17 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.863 0.865 . . . . 65.44 109.579 -177.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 78.0 mtp180 -92.22 156.95 16.96 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.963 0.905 . . . . 71.31 111.328 -175.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 51.0 m -106.96 -163.71 0.93 Allowed 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 123.967 0.907 . . . . 70.35 109.85 173.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 p 38.75 75.06 0.59 Allowed Pre-proline 0 CA--C 1.569 1.693 0 C-N-CA 126.014 1.726 . . . . 74.43 113.762 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -81.6 151.31 17.1 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.713 2.275 . . . . 74.22 111.763 177.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.524 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 28.9 m -66.25 152.89 43.94 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.252 0.621 . . . . 74.1 111.033 176.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -61.07 -45.28 95.39 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.128 0.571 . . . . 64.22 111.111 177.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 43.6 mtmt -59.08 -41.38 87.9 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.088 0.555 . . . . 75.4 110.878 176.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.524 ' HB2' ' HB2' ' A' ' 55' ' ' SER . 12.2 tp -65.53 -48.77 71.34 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 114.641 -1.163 . . . . 74.14 110.151 -172.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.2 m -67.28 -39.27 86.01 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 114.915 -1.039 . . . . 71.11 111.05 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 87.9 m -65.62 -36.9 85.05 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.145 0.578 . . . . 64.14 111.256 177.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.28 -45.51 84.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.186 0.595 . . . . 74.21 109.774 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.548 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.8 mmt -68.71 -20.87 64.42 Favored 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.034 -0.985 . . . . 72.21 112.327 176.217 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -74.62 -42.86 57.85 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.242 0.617 . . . . 70.13 109.905 174.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -62.15 -41.5 98.34 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.287 0.635 . . . . 74.3 109.827 174.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.412 ' O ' HD23 ' A' ' 69' ' ' LEU . 0.9 OUTLIER -64.9 -50.99 64.34 Favored 'General case' 0 C--N 1.351 0.638 0 CA-C-N 114.396 -1.274 . . . . 65.43 109.75 -177.023 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -53.62 -49.37 67.99 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.311 1.044 . . . . 64.1 110.357 176.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -60.91 -36.76 80.11 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.315 1.009 . . . . 72.25 111.773 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.55 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.59 -43.04 85.99 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.303 0.641 . . . . 61.4 110.862 178.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -70.36 -25.82 63.44 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.365 0.666 . . . . 75.35 111.559 175.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -65.25 -50.45 65.73 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-O 121.078 0.466 . . . . 55.3 109.949 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -64.61 -38.96 92.8 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 114.96 -1.018 . . . . 60.32 110.746 -179.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.407 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -61.72 -47.33 85.74 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.082 0.553 . . . . 70.53 110.904 176.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -59.67 -38.46 81.55 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 124.155 0.91 . . . . 73.31 110.814 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -69.36 -42.04 75.79 Favored Glycine 0 C--N 1.349 1.275 0 O-C-N 123.962 0.789 . . . . 62.41 113.118 179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -65.08 -41.59 94.9 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 122.605 0.362 . . . . 71.34 111.073 -178.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.518 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 4.3 pt -80.76 -18.5 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.502 0.556 . . . . 63.52 112.502 177.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -64.68 -33.69 76.54 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 109.127 -0.694 . . . . 71.43 109.127 165.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.7 mttm -76.75 -39.53 51.44 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.754 -0.657 . . . . 71.3 110.894 173.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.518 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.4 m-30 -74.11 -12.4 60.59 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 112.867 0.692 . . . . 72.42 112.867 -177.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 81.2 p -61.0 -31.12 70.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-O 121.024 0.44 . . . . 64.32 110.276 178.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -89.65 115.87 27.35 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.179 -1.045 . . . . 74.5 108.179 167.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -74.35 -25.13 59.34 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.784 0.834 . . . . 72.32 110.992 -172.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -68.71 -34.45 75.67 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.628 0.771 . . . . 71.01 110.31 174.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -69.9 -35.54 74.7 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.398 0.679 . . . . 72.22 110.359 177.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.465 ' O ' ' HB2' ' A' ' 89' ' ' LEU . 36.5 mt -58.65 -58.68 5.63 Favored 'Isoleucine or valine' 0 C--N 1.368 1.397 0 N-CA-C 108.827 -0.805 . . . . 73.52 108.827 171.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.0 t -53.0 -37.98 61.92 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.005 0.922 . . . . 41.0 111.825 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 19.2 tpp180 -62.6 -52.26 64.07 Favored 'General case' 0 C--N 1.351 0.649 0 CA-C-N 115.123 -0.944 . . . . 75.04 111.266 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -71.35 -28.94 64.41 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.146 -0.316 . . . . 74.31 110.146 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 145' ' ' ARG . 11.5 tp -74.81 -39.36 61.72 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.695 1.198 . . . . 72.42 111.524 -166.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 15.3 t -67.22 -22.94 65.69 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.235 -0.893 . . . . 64.14 110.661 177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -105.3 -10.2 17.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.509 0.724 . . . . 64.13 112.149 -178.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 92.2 p -71.08 125.2 26.26 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.682 0.393 . . . . 73.14 110.139 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -74.43 -35.09 63.38 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.216 0.606 . . . . 70.1 110.172 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -83.86 170.8 13.71 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 121.749 0.785 . . . . 73.42 110.884 169.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.461 ' HA ' ' HG3' ' A' ' 145' ' ' ARG . 89.4 mttt -105.44 -29.01 10.49 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.436 -1.256 . . . . 71.22 110.263 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.483 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.5 mp -74.76 126.89 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 N-CA-C 108.593 -0.892 . . . . 53.33 108.593 -176.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.661 ' HG ' ' HG3' ' A' ' 27' ' ' GLN . 15.5 mt -65.19 -38.98 92.2 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 122.173 0.987 . . . . 75.44 110.093 177.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.419 ' CD1' ' HB2' ' A' ' 97' ' ' LEU . 56.7 m-85 -107.07 43.86 1.12 Allowed 'General case' 0 C--O 1.213 -0.846 0 CA-C-N 113.715 -1.584 . . . . 71.31 109.445 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? -63.46 -64.81 0.8 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.357 -0.979 . . . . 73.55 108.357 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -66.74 -42.82 85.65 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.785 -1.098 . . . . 74.34 110.302 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.49 ' HA ' ' HD2' ' A' ' 104' ' ' LYS . 50.0 t -59.65 -54.74 30.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 O-C-N 124.149 0.906 . . . . 73.13 111.278 -177.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.406 HD21 ' HB3' ' A' ' 133' ' ' TRP . 65.2 t30 -72.07 -25.82 61.93 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 119.186 -0.435 . . . . 74.24 110.727 -176.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 27.6 ttt180 -61.0 -43.93 98.16 Favored 'General case' 0 N--CA 1.479 0.994 0 N-CA-C 109.815 -0.439 . . . . 75.11 109.815 171.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.49 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 42.5 mttm -60.36 -57.45 12.72 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.902 0.881 . . . . 72.44 110.744 175.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.55 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.2 mp -54.6 -41.0 69.43 Favored 'General case' 0 N--CA 1.484 1.268 0 O-C-N 123.9 0.75 . . . . 75.12 111.348 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 17.2 t -71.64 -42.11 67.98 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.346 0.658 . . . . 43.54 111.264 -176.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.731 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 17.7 t70 -71.93 -44.96 62.77 Favored 'General case' 0 C--O 1.254 1.305 0 O-C-N 123.623 0.577 . . . . 63.1 110.718 -175.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 93.7 t -58.57 -49.74 81.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.574 0 CA-C-N 115.003 -0.999 . . . . 72.22 109.173 174.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 55.1 t-105 -64.16 -29.07 70.21 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.011 0.819 . . . . 71.52 111.83 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.731 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 40.8 mtpt -56.69 -67.69 0.29 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 108.54 -0.911 . . . . 63.43 108.54 172.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.16 -29.84 71.11 Favored 'General case' 0 N--CA 1.477 0.925 0 O-C-N 124.084 0.865 . . . . 71.44 111.902 -176.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.509 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 5.3 tt -72.52 -50.21 27.38 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.622 0.769 . . . . 74.42 110.142 -175.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 96.4 p -62.08 -37.6 85.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.446 0.298 . . . . 51.32 110.689 177.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 94.1 mt -60.11 -44.62 94.72 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.372 -0.831 . . . . 74.42 111.701 176.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -78.49 -21.8 48.43 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 112.23 0.456 . . . . 64.44 112.23 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 84.7 mt -63.97 -43.19 96.53 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 108.918 -0.771 . . . . 61.12 108.918 169.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.444 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -68.69 -47.47 66.34 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.698 0.799 . . . . 51.24 112.269 175.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 26.2 t -64.19 -60.65 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.23 0.612 . . . . 73.32 111.372 -177.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -86.32 -54.47 4.42 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-N 115.797 -0.638 . . . . 62.34 111.37 -168.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -88.37 -6.27 57.81 Favored 'General case' 0 CA--C 1.555 1.146 0 N-CA-C 112.503 0.557 . . . . 74.45 112.503 -175.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 52.7 ttt85 66.16 7.57 4.91 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.854 1.262 . . . . 72.22 112.771 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 37.1 mtp -65.46 118.34 49.63 Favored Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 124.258 1.023 . . . . 65.52 111.423 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -81.82 51.61 3.9 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 123.612 2.874 . . . . 71.14 112.559 -176.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.13 105.68 11.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 123.731 0.813 . . . . 75.34 109.882 -176.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 15.0 t -148.24 68.12 10.16 Favored Pre-proline 0 CA--C 1.55 0.96 0 CA-C-N 115.753 -0.658 . . . . 41.52 110.013 176.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.61 7.85 4.96 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.567 2.178 . . . . 72.34 112.563 177.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.42 HD13 ' HA2' ' A' ' 130' ' ' GLY . 17.8 tt -147.21 -31.0 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 C-N-CA 124.169 0.988 . . . . 75.13 110.236 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 19.7 m 73.04 -65.93 0.33 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 125.415 1.486 . . . . 52.42 112.316 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -72.34 -67.68 0.53 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.021 0.528 . . . . 72.22 111.435 -176.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.42 ' HA2' HD13 ' A' ' 127' ' ' ILE . . . 90.38 -29.8 6.42 Favored Glycine 0 N--CA 1.48 1.568 0 N-CA-C 112.666 -0.173 . . . . 73.32 112.666 -176.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -76.03 -13.36 60.23 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.4 1.08 . . . . 52.35 111.306 172.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 5.5 m -46.4 -40.17 11.64 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.125 1.37 . . . . 74.25 112.338 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.492 ' CE2' ' HG2' ' A' ' 34' ' ' ARG . 37.3 m0 -60.28 -32.64 71.37 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 114.653 -1.158 . . . . 72.33 113.141 -177.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -62.46 -27.97 69.49 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 122.749 0.42 . . . . 64.03 111.612 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -88.81 -46.6 8.83 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.636 0.774 . . . . 62.21 110.705 174.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 30' ' ' ARG . 49.8 mt-10 -64.11 -62.56 1.55 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.152 0.981 . . . . 72.22 111.6 -174.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -53.84 -34.07 58.18 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.871 0.869 . . . . 72.24 111.895 176.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -67.13 -52.04 46.56 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.109 0.564 . . . . 73.24 112.216 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -60.74 -48.69 80.67 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 123.556 0.535 . . . . 64.43 109.902 -177.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -61.47 -38.31 86.8 Favored 'General case' 0 C--O 1.22 -0.492 0 CA-C-N 114.248 -1.342 . . . . 64.23 110.313 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.0 97.6 Favored 'General case' 0 C--O 1.22 -0.46 0 O-C-N 124.121 0.888 . . . . 51.44 112.374 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -61.33 -47.78 84.36 Favored 'General case' 0 C--O 1.221 -0.397 0 N-CA-C 109.181 -0.674 . . . . 74.15 109.181 176.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -58.93 -48.25 82.13 Favored 'General case' 0 CA--C 1.555 1.141 0 O-C-N 124.389 1.055 . . . . 74.11 111.35 179.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 24' ' ' CYS . 64.3 m-20 -70.33 -56.11 7.51 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 124.079 0.952 . . . . 62.43 112.378 -176.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.513 ' HG2' HD11 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -62.11 -43.07 99.65 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 124.318 1.047 . . . . 72.32 109.738 -173.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 17.7 ttm180 -63.45 -49.76 72.4 Favored 'General case' 0 N--CA 1.471 0.623 0 O-C-N 123.971 0.794 . . . . 75.43 109.632 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.63 -32.73 70.71 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 112.312 0.486 . . . . 71.12 112.312 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -71.99 -45.62 60.27 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 123.31 0.644 . . . . 70.42 109.555 178.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -76.51 -13.25 60.11 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 115.754 -0.657 . . . . 75.13 112.096 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 48.8 mtm -97.57 -77.59 0.5 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 109.084 -0.709 . . . . 63.53 109.084 173.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 95.8 mt 61.63 178.69 0.12 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.907 1.283 . . . . 53.34 111.663 -172.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -166.33 42.7 0.06 Allowed 'General case' 0 N--CA 1.484 1.229 0 CA-C-O 121.572 0.701 . . . . 65.5 110.862 176.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -136.19 -59.56 0.74 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.865 0.866 . . . . 71.44 109.766 175.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -122.12 28.73 7.36 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 124.184 0.994 . . . . 63.4 109.857 -172.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 25.2 p-10 -107.27 130.02 54.81 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.764 0.826 . . . . 73.34 109.924 178.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 . . . . . 0 CA--C 1.554 1.129 0 C-N-CA 124.194 0.998 . . . . 73.11 109.004 173.378 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.3 ttp . . . . . 0 N--CA 1.496 1.873 0 CA-C-O 120.878 0.371 . . . . 70.11 110.197 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -30.05 34.28 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 123.902 0.881 . . . . 75.32 111.515 171.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -55.42 -45.05 76.75 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.857 0.863 . . . . 64.22 110.535 173.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -65.12 -41.53 94.77 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.364 -0.834 . . . . 64.05 110.69 177.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 46.7 mtpt -57.19 -43.4 82.63 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 123.746 0.654 . . . . 75.53 110.862 177.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.0 m-70 -60.71 -55.71 29.95 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 123.619 0.574 . . . . 72.32 110.584 178.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.26 -49.39 72.84 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.817 0.847 . . . . 72.43 111.761 -177.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 80.5 mt -71.12 -43.59 75.36 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 124.708 1.203 . . . . 73.41 111.197 -172.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.441 ' O ' HG23 ' A' ' 13' ' ' VAL . 97.5 m -63.45 -48.88 75.89 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.697 0.399 . . . . 65.31 110.536 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 65.1 mt -53.71 -50.36 66.07 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 124.05 0.843 . . . . 75.15 110.471 177.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.69 -52.31 46.56 Favored Glycine 0 C--N 1.348 1.2 0 O-C-N 124.602 1.189 . . . . 73.51 112.996 179.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.69 -48.24 82.45 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.773 0.429 . . . . 64.24 111.463 179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 9' ' ' THR . 46.5 t -68.34 -25.24 30.93 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 C-N-CA 123.086 0.554 . . . . 73.41 111.061 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.489 HD11 ' O ' ' A' ' 69' ' ' LEU . 33.4 mt -64.43 -48.4 85.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 123.83 0.852 . . . . 70.4 109.181 172.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.469 ' HB2' HG11 ' A' ' 35' ' ' VAL . 38.9 t-80 -59.37 -37.71 78.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.404 0.681 . . . . 74.03 111.134 176.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -63.75 -59.02 5.1 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 123.804 0.69 . . . . 74.23 110.966 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -74.69 -16.82 60.74 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.063 0.545 . . . . 75.31 111.755 -173.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.63 -23.22 65.32 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.365 0.666 . . . . 73.11 111.289 175.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -70.96 -8.52 53.7 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.165 0.586 . . . . 73.33 111.653 178.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.5 mm-40 -63.85 -23.27 67.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.597 0.359 . . . . 63.01 111.153 170.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 7.2 mmt -74.88 87.44 2.28 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 108.697 -0.853 . . . . 72.3 108.697 176.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -36.09 75.13 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 107.359 -1.348 . . . . 72.53 107.359 168.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -89.72 175.91 7.06 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 114.622 -1.172 . . . . 74.21 108.454 171.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.613 ' SG ' HG21 ' A' ' 85' ' ' ILE . 99.9 m 57.79 74.03 0.44 Allowed 'General case' 0 CA--C 1.547 0.86 0 O-C-N 123.796 0.685 . . . . 61.23 110.405 -172.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -64.76 -60.44 3.09 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.731 1.212 . . . . 73.21 110.585 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.569 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 57.5 mmtt -63.67 -49.46 73.07 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-N 115.145 -0.934 . . . . 75.24 110.381 -177.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 31' ' ' LEU . 14.0 mt-30 -60.55 -34.91 74.83 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.1 0.56 . . . . 75.23 112.243 -177.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 47.4 t -74.21 -44.43 53.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.619 0.368 . . . . 72.14 110.948 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -65.79 -38.82 90.05 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 122.713 0.405 . . . . 74.42 110.911 179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' NH2' ' HA ' ' A' ' 137' ' ' ASP . 18.2 mtp180 -67.9 -38.47 83.01 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.123 0.969 . . . . 64.03 110.627 176.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.8 OUTLIER -60.05 -50.81 72.24 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.995 0.81 . . . . 73.32 108.91 178.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.66 -40.2 97.31 Favored Glycine 0 C--N 1.348 1.211 0 O-C-N 123.971 0.795 . . . . 64.13 113.202 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 -57.0 -47.76 80.05 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.35 1.06 . . . . 74.43 110.71 175.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.412 ' CZ ' HD21 ' A' ' 102' ' ' ASN . 69.5 mtt-85 -64.68 -48.78 73.47 Favored 'General case' 0 C--O 1.216 -0.67 0 CA-C-N 114.726 -1.124 . . . . 73.41 110.753 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.469 HG11 ' HB2' ' A' ' 15' ' ' HIS . 41.7 t -54.09 -61.62 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.518 0 O-C-N 124.148 0.905 . . . . 60.42 111.185 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.488 ' O ' ' HD3' ' A' ' 40' ' ' LYS . 72.2 mt -65.39 -46.42 80.14 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 124.074 0.859 . . . . 61.51 110.564 -172.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -56.5 -37.78 76.97 Favored Glycine 0 CA--C 1.531 1.09 0 CA-C-N 116.058 -0.519 . . . . 74.3 113.069 176.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.46 HD21 ' HE1' ' A' ' 65' ' ' PHE . 18.0 tp -84.33 -38.13 20.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.853 0.861 . . . . 73.45 112.471 -173.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.437 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 16.3 pt -75.46 -37.45 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 119.42 -0.324 . . . . 74.2 110.871 -176.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' A' ' 36' ' ' LEU . 5.6 mptp? -51.7 -51.81 66.59 Favored Pre-proline 0 N--CA 1.485 1.296 0 N-CA-C 114.021 1.119 . . . . 75.11 114.021 -174.501 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 19.6 Cg_endo -55.43 -37.52 94.74 Favored 'Trans proline' 0 C--N 1.395 3.007 0 C-N-CA 122.357 2.038 . . . . 64.43 112.669 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -69.68 -40.77 76.19 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.377 0.671 . . . . 72.33 110.658 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 92.7 mt-10 -66.74 -37.13 84.04 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.405 1.082 . . . . 74.42 111.299 -179.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 34.6 mmt -65.76 -40.15 91.77 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.728 0.642 . . . . 64.31 110.431 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -76.82 -38.26 54.18 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 116.281 -0.418 . . . . 62.34 110.403 175.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -39.2 87.65 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.485 0.714 . . . . 54.42 111.67 -178.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -71.86 -40.79 68.74 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.866 0.866 . . . . 61.25 110.899 -178.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -86.11 -61.13 1.82 Allowed 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 116.079 -0.509 . . . . 72.24 111.138 -176.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 172.79 86.18 0.06 OUTLIER Glycine 0 C--N 1.337 0.628 0 N-CA-C 112.256 -0.338 . . . . 63.42 112.256 177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -90.65 159.73 16.25 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.425 0.69 . . . . 53.41 109.813 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.645 ' HG3' HE21 ' A' ' 120' ' ' GLN . 41.1 mmt180 -47.76 96.37 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.222 1.409 . . . . 74.13 111.836 175.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.4 m -72.03 -43.29 65.23 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 114.634 -1.166 . . . . 71.54 109.655 174.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 t -113.72 89.68 16.51 Favored Pre-proline 0 CA--C 1.548 0.897 0 N-CA-C 107.758 -1.201 . . . . 75.31 107.758 171.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.47 ' HB2' ' HB2' ' A' ' 58' ' ' LEU . 36.4 Cg_endo -91.65 -167.56 0.21 Allowed 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 123.041 2.494 . . . . 75.44 112.587 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 19.3 m -83.83 166.24 18.12 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.217 0.607 . . . . 71.11 109.684 172.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -59.98 -38.29 82.12 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 122.958 0.503 . . . . 74.41 110.735 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.565 ' HG3' HD22 ' A' ' 58' ' ' LEU . 61.8 pttt -62.42 -37.27 85.2 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.371 0.668 . . . . 55.24 111.626 179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 115' ' ' LEU . 4.0 mm? -65.96 -51.12 61.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 122.674 0.39 . . . . 73.12 110.172 175.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 19.5 m -58.67 -45.42 89.42 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 124.11 0.881 . . . . 70.15 111.229 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 51.0 m -59.73 -44.89 93.57 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.875 0.87 . . . . 65.32 110.212 176.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.67 -44.44 96.47 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 123.706 0.629 . . . . 75.41 111.494 178.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 4.6 mmt -67.45 -31.47 71.66 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.82 0.848 . . . . 61.31 111.141 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -74.29 -44.9 50.78 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.677 0.791 . . . . 73.22 111.057 -179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 66.6 mtp85 -61.25 -44.2 97.63 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.768 0.827 . . . . 73.14 109.727 175.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.46 ' HE1' HD21 ' A' ' 38' ' ' LEU . 3.4 t80 -59.62 -58.13 9.93 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 113.533 -1.667 . . . . 51.11 109.958 -178.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.502 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 24.9 ttpp -52.71 -45.53 66.93 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 124.6 1.187 . . . . 73.2 110.913 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.67 -38.82 79.03 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 124.311 1.007 . . . . 70.53 111.785 179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.15 -34.8 71.34 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.339 0.656 . . . . 72.01 111.737 176.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.489 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.1 mm? -63.84 -40.12 95.84 Favored 'General case' 0 C--N 1.365 1.244 0 C-N-CA 122.554 0.342 . . . . 63.1 110.737 170.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 37.5 mt-10 -63.4 -42.07 98.77 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.151 0.58 . . . . 73.05 110.413 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.427 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 39.1 mt-10 -58.26 -54.65 44.65 Favored 'General case' 0 C--N 1.355 0.837 0 CA-C-N 114.907 -1.042 . . . . 71.22 110.124 175.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -56.19 -43.67 78.67 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 124.569 1.168 . . . . 74.41 111.884 -177.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -57.06 -51.64 68.48 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 124.68 1.237 . . . . 54.2 109.854 179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.04 -31.31 80.48 Favored Glycine 0 CA--C 1.535 1.282 0 CA-C-N 115.036 -0.984 . . . . 71.21 114.171 178.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 78' ' ' LYS . 29.8 mm-40 -67.65 -56.42 9.45 Favored 'General case' 0 C--N 1.356 0.879 0 CA-C-N 116.947 0.373 . . . . 74.35 110.396 179.543 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.56 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -59.29 -28.26 38.88 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.03 0 O-C-N 121.937 -0.477 . . . . 74.43 111.43 175.557 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -60.07 -46.52 89.31 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.037 0.384 . . . . 52.21 112.037 171.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.57 ' HG2' ' O ' ' A' ' 75' ' ' GLU . 14.1 ptpt -73.77 -25.29 60.08 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 117.852 0.296 . . . . 60.43 110.87 178.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.58 -2.41 57.37 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.541 0.736 . . . . 74.35 112.851 179.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.9 p -57.13 -31.14 65.02 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.978 0.511 . . . . 74.44 111.189 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -83.83 115.51 22.28 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 107.913 -1.143 . . . . 63.52 107.913 165.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -74.3 -23.02 59.03 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.482 0.713 . . . . 63.4 111.083 -172.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.8 p -59.82 -32.34 70.56 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.071 0.948 . . . . 71.53 111.765 171.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -63.17 -42.28 99.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.423 0.689 . . . . 64.03 110.327 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.613 HG21 ' SG ' ' A' ' 24' ' ' CYS . 52.5 mt -59.63 -58.7 5.94 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.841 0 CA-C-N 114.812 -1.086 . . . . 63.32 109.44 178.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.0 t -56.5 -35.6 68.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.153 0.581 . . . . 74.32 111.693 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 17.6 tpt180 -57.38 -58.32 8.78 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.426 1.09 . . . . 53.32 111.621 178.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.405 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 1.7 p90 -75.47 -34.7 60.93 Favored 'General case' 0 CA--C 1.549 0.928 0 N-CA-C 109.779 -0.452 . . . . 72.32 109.779 -177.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.555 HD23 HE22 ' A' ' 149' ' ' GLN . 12.7 tp -66.32 -37.94 86.52 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.65 1.18 . . . . 75.25 111.503 -168.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.5 t -66.67 -19.43 65.76 Favored 'General case' 0 CA--C 1.552 1.032 0 CA-C-N 115.86 -0.609 . . . . 73.41 111.221 178.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -100.94 -23.0 14.63 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 124.101 0.96 . . . . 70.45 111.423 175.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.718 ' HB3' ' HB3' ' A' ' 95' ' ' LYS . 74.4 m -96.89 106.4 18.71 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.368 1.067 . . . . 63.24 110.721 -174.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -86.45 -45.25 11.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.603 0.761 . . . . 75.12 111.681 -173.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -124.5 -3.34 7.87 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.92 0.888 . . . . 74.51 111.105 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.718 ' HB3' ' HB3' ' A' ' 92' ' ' SER . 47.3 tptt -70.05 93.58 0.81 Allowed 'General case' 0 C--O 1.243 0.732 0 N-CA-C 107.694 -1.224 . . . . 71.24 107.694 170.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.501 HD12 ' HB3' ' A' ' 141' ' ' ALA . 14.1 mm -62.75 155.28 5.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 CA-C-N 114.961 -1.018 . . . . 72.4 108.826 178.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.405 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 2.0 tp -50.54 -43.71 56.2 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-O 121.632 0.729 . . . . 75.31 111.582 -174.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.56 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 3.5 m-85 -118.05 25.09 10.58 Favored 'General case' 0 C--O 1.209 -1.053 0 CA-C-N 114.421 -1.263 . . . . 55.34 110.797 -178.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -40.34 -56.95 1.87 Allowed 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 124.535 1.134 . . . . 63.4 112.559 -167.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -70.96 -55.32 8.59 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.184 0.993 . . . . 65.03 111.074 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 71.3 t -59.4 -46.1 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 124.29 1.036 . . . . 71.11 111.954 -174.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.412 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 51.0 t30 -76.38 -28.73 56.87 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.983 1.313 . . . . 73.13 110.407 -177.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 31.7 tpt180 -62.48 -39.4 93.32 Favored 'General case' 0 N--CA 1.484 1.239 0 N-CA-C 109.85 -0.426 . . . . 71.41 109.85 168.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -68.39 -36.94 79.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.38 0.672 . . . . 64.4 110.464 175.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 32.3 mt -65.84 -39.15 90.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.854 0.461 . . . . 72.01 110.777 174.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 66.1 m -72.6 -41.06 66.02 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.368 0.667 . . . . 71.12 111.209 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.497 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 15.9 t70 -80.1 -36.3 35.63 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 122.748 0.419 . . . . 70.44 110.599 -176.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.477 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 39.2 t -69.85 -28.78 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 110.084 -0.339 . . . . 63.34 110.084 172.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 14.7 t-105 -69.43 -34.84 75.03 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 119.333 -0.365 . . . . 70.52 110.703 170.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 51.8 mtpt -57.22 -57.61 11.85 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 109.616 -0.513 . . . . 71.12 109.616 171.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 45.2 mt-10 -51.72 -47.18 64.09 Favored 'General case' 0 C--N 1.358 0.94 0 O-C-N 124.447 1.092 . . . . 72.55 110.415 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.8 OUTLIER -64.08 -60.46 3.21 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 124.176 0.99 . . . . 72.4 109.965 -173.057 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.5 p -53.27 -38.94 63.5 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.065 0.946 . . . . 63.52 111.513 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.452 ' O ' HG23 ' A' ' 118' ' ' VAL . 96.6 mt -60.2 -62.78 1.61 Allowed 'General case' 0 CA--C 1.545 0.777 0 O-C-N 123.703 0.627 . . . . 65.33 111.149 175.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.618 HD13 HD13 ' A' ' 58' ' ' LEU . 2.5 pp -65.9 -23.15 66.58 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 112.724 0.639 . . . . 72.23 112.724 -176.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.419 HD13 ' SD ' ' A' ' 122' ' ' MET . 80.8 mt -72.86 -42.28 63.84 Favored 'General case' 0 C--O 1.216 -0.692 0 C-N-CA 123.483 0.713 . . . . 71.44 110.001 175.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -75.77 -26.01 56.97 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 122.506 0.322 . . . . 63.24 111.402 178.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 114' ' ' LEU . 77.8 t -75.25 -61.81 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 109.695 -0.483 . . . . 64.32 109.695 177.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.22 -59.02 2.37 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 122.977 0.511 . . . . 75.31 110.066 -170.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.645 HE21 ' HG3' ' A' ' 51' ' ' ARG . 27.8 mp0 -76.85 -14.09 59.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.241 0.616 . . . . 74.4 111.569 -174.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 63.65 22.84 13.3 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 124.884 1.274 . . . . 75.44 111.04 178.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.528 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 48.6 ttm -55.45 115.41 9.24 Favored Pre-proline 0 C--N 1.357 0.894 0 C-N-CA 124.654 1.182 . . . . 71.54 111.999 -173.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.47 91.98 1.16 Allowed 'Trans proline' 0 C--N 1.367 1.502 0 C-N-CA 122.108 1.872 . . . . 61.4 109.72 172.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 21.2 m -67.04 88.03 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.098 0 CA-C-O 122.32 1.057 . . . . 65.42 109.954 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 37.1 m -97.05 -48.35 0.23 Allowed Pre-proline 0 CA--C 1.563 1.467 0 CA-C-N 114.313 -1.312 . . . . 74.01 112.21 -176.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -69.36 -12.68 34.21 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.823 1.682 . . . . 74.1 112.998 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 14.9 tt -148.84 155.67 8.57 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 123.929 0.892 . . . . 53.41 109.061 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 16.1 t -104.35 -165.91 1.19 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.442 0.697 . . . . 61.22 109.638 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -57.81 -40.5 80.12 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 123.899 0.88 . . . . 73.34 111.88 179.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 120.44 37.63 0.72 Allowed Glycine 0 C--N 1.345 1.033 0 CA-C-N 115.963 -0.562 . . . . 71.55 112.275 -177.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.67 87.72 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.327 0.651 . . . . 63.33 109.501 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 35.7 t -60.01 -35.96 76.18 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 114.782 -1.099 . . . . 61.53 110.913 173.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.404 ' HH2' HD22 ' A' ' 38' ' ' LEU . 11.3 m0 -68.52 -17.26 64.12 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.428 1.091 . . . . 75.31 113.286 -171.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.52 -40.76 18.76 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 121.781 -0.574 . . . . 70.21 110.721 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -73.35 -39.05 65.5 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-N 114.989 -1.005 . . . . 71.4 111.481 -171.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' A' ' 140' ' ' ASP . 41.7 mt-10 -52.59 -56.82 12.63 Favored 'General case' 0 C--N 1.36 1.058 0 C-N-CA 124.917 1.287 . . . . 75.14 111.068 -179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.498 ' HA ' ' NH2' ' A' ' 30' ' ' ARG . 3.5 m-20 -63.5 -57.64 9.57 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 115.031 -0.986 . . . . 74.1 112.368 -172.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -59.23 -58.89 6.66 Favored 'General case' 0 CA--C 1.561 1.404 0 O-C-N 123.062 0.226 . . . . 75.51 111.406 -178.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -70.82 -56.19 6.87 Favored 'General case' 0 C--N 1.351 0.669 0 C-N-CA 122.36 0.264 . . . . 74.2 110.63 -170.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.409 ' HB2' ' O ' ' A' ' 136' ' ' GLU . 5.5 m-20 -74.99 -28.84 60.7 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-O 118.299 -0.858 . . . . 71.43 112.254 -170.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.501 ' HB3' HD12 ' A' ' 96' ' ' ILE . . . -78.89 -24.44 44.2 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-N 119.655 1.116 . . . . 74.13 110.967 176.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -65.84 -47.03 76.37 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 109.745 -0.465 . . . . 75.14 109.745 167.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.69 -39.66 77.66 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.952 0.901 . . . . 64.1 110.781 175.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.569 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 29.8 t0 -75.02 -42.93 56.32 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.198 0.999 . . . . 71.1 111.906 -172.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 61.6 ttt-85 -64.7 -41.7 95.83 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 115.1 -0.954 . . . . 71.14 109.719 178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -65.09 -34.9 79.51 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.186 -0.915 . . . . 71.32 110.806 172.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -75.56 -19.56 59.22 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.855 0.462 . . . . 73.52 111.491 178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -78.63 -58.79 3.06 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 108.866 -0.79 . . . . 64.03 108.866 177.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . 0.555 HE22 HD23 ' A' ' 89' ' ' LEU . 1.9 mp0 -70.14 -46.72 64.13 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.587 0.755 . . . . 54.01 111.494 -175.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 75.3 mtp -96.86 36.25 1.43 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.572 0.749 . . . . 72.34 110.397 -178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 50.5 tp -62.7 111.87 2.27 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.703 0.801 . . . . 65.14 110.702 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.4 mtt85 -99.29 16.67 22.21 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.065 0.546 . . . . 60.42 110.763 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.07 105.62 11.19 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 108.802 -0.814 . . . . 73.02 108.802 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 65.17 13.67 8.89 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 124.975 1.31 . . . . 74.04 113.147 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -99.88 148.22 24.68 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.874 0.869 . . . . 64.42 109.233 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 . . . . . 0 CA--C 1.557 1.241 0 C-N-CA 124.804 1.241 . . . . 70.11 110.845 -178.206 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.597 0.237 . . . . 75.1 110.566 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -76.23 -52.79 9.3 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.079 0.551 . . . . 75.14 110.553 178.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -61.07 -41.01 95.83 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 123.885 0.74 . . . . 71.54 109.484 177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.425 HD11 HD12 ' A' ' 42' ' ' LEU . 3.6 mm? -58.17 -52.11 66.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.303 0.641 . . . . 75.34 110.409 174.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -53.85 -38.67 64.91 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.135 0.574 . . . . 72.31 111.083 178.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.417 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 41.5 t-80 -65.88 -49.5 67.85 Favored 'General case' 0 CA--C 1.551 0.982 0 O-C-N 123.805 0.691 . . . . 75.3 110.49 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.0 mt -57.96 -52.58 56.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 124.876 1.27 . . . . 71.21 111.477 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.418 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -64.71 -40.87 90.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 124.035 0.934 . . . . 70.34 110.693 -177.089 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 55.3 m -62.75 -42.5 99.71 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.693 0.397 . . . . 72.22 110.75 176.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 79.6 mt -57.4 -56.65 19.09 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.37 0.419 . . . . 72.12 110.084 177.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.4 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -62.58 -35.7 92.18 Favored Glycine 0 C--N 1.35 1.353 0 O-C-N 124.279 0.987 . . . . 63.11 113.827 -176.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.447 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 4.5 tp-100 -70.38 -49.5 48.42 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 109.636 -0.505 . . . . 74.13 109.636 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 68.8 t -60.99 -33.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 C-N-CA 123.564 0.746 . . . . 72.02 110.774 175.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.4 HD12 ' HA2' ' A' ' 11' ' ' GLY . 23.1 mt -54.61 -55.96 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 123.949 0.9 . . . . 64.5 109.768 173.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 74.4 t60 -60.39 -38.7 84.79 Favored 'General case' 0 CA--C 1.551 0.983 0 O-C-N 124.155 0.909 . . . . 71.42 111.686 -179.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.447 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 13.5 mptt -60.84 -54.64 42.71 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 124.008 0.923 . . . . 63.23 111.918 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -79.48 -19.22 50.29 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.461 0.704 . . . . 62.22 111.989 -175.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 38.6 t -64.33 -17.81 64.03 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.365 1.066 . . . . 75.41 113.068 177.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -55.42 -20.63 12.82 Favored 'General case' 0 N--CA 1.496 1.847 0 C-N-CA 123.961 0.905 . . . . 72.31 112.915 175.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -62.8 -29.87 71.04 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.408 0.683 . . . . 73.31 112.472 175.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.422 ' HB2' ' HB2' ' A' ' 28' ' ' CYS . 8.3 mmt -78.45 81.83 4.76 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-O 121.101 0.477 . . . . 44.11 110.679 -173.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 ttpt -80.55 -34.51 35.4 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 108.139 -1.06 . . . . 60.32 108.139 169.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.45 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 85.7 m-85 -90.81 153.32 20.32 Favored 'General case' 0 C--O 1.244 0.783 0 CA-C-N 114.186 -1.37 . . . . 71.42 108.217 170.099 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.3 m 57.81 70.99 0.61 Allowed 'General case' 0 CA--C 1.546 0.791 0 CA-C-O 122.369 1.08 . . . . 53.53 109.536 -166.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.427 ' H ' ' HD2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -75.08 -48.69 22.65 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 113.803 -1.544 . . . . 53.43 109.411 -170.559 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 4.0 mptp? -61.68 -37.37 83.84 Favored 'General case' 0 C--O 1.206 -1.204 0 N-CA-C 109.416 -0.587 . . . . 75.21 109.416 177.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.77 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 16.0 mm-40 -66.25 -43.85 85.37 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-N 117.862 0.301 . . . . 51.33 111.16 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.422 ' HB2' ' HB2' ' A' ' 21' ' ' MET . 52.7 t -66.78 -43.02 85.08 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.906 0.882 . . . . 73.12 111.874 -179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HD3' ' O ' ' A' ' 25' ' ' LYS . 10.3 mpt_? -80.93 -33.55 33.97 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.557 0.743 . . . . 72.43 111.033 -174.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.511 ' NH2' ' HB2' ' A' ' 136' ' ' GLU . 25.6 tpt180 -73.16 -38.63 66.15 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 109.185 -0.672 . . . . 51.0 109.185 176.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.73 -46.33 90.11 Favored 'General case' 0 C--N 1.357 0.924 0 O-C-N 123.815 0.697 . . . . 74.12 109.159 173.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.2 -46.22 93.07 Favored Glycine 0 C--N 1.349 1.298 0 O-C-N 123.879 0.737 . . . . 54.44 112.63 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -60.46 -52.82 63.59 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.453 0.701 . . . . 52.01 110.452 178.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.54 HH12 ' HB2' ' A' ' 106' ' ' SER . 16.3 mtt180 -58.81 -63.4 1.31 Allowed 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.094 0.871 . . . . 60.15 110.547 -177.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.428 ' O ' HG12 ' A' ' 39' ' ' ILE . 55.8 t -50.93 -50.57 23.51 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 C-N-CA 124.305 1.042 . . . . 70.05 111.942 -175.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.5 mp -62.46 -41.54 98.83 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 123.369 0.418 . . . . 71.25 111.188 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.55 -23.55 72.12 Favored Glycine 0 N--CA 1.474 1.17 0 CA-C-N 116.325 -0.398 . . . . 61.5 113.34 177.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.571 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 27.6 mt -87.2 -46.98 9.24 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.471 0.708 . . . . 54.2 111.301 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.428 HG12 ' O ' ' A' ' 35' ' ' VAL . 23.0 pt -80.47 -41.55 20.48 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-O 117.933 -1.032 . . . . 64.34 111.917 -170.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -54.77 -48.27 95.97 Favored Pre-proline 0 N--CA 1.497 1.891 0 N-CA-C 113.724 1.009 . . . . 75.43 113.724 -174.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_exo -54.76 -39.36 89.94 Favored 'Trans proline' 0 C--N 1.391 2.785 0 C-N-CA 122.1 1.866 . . . . 61.33 112.868 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 45' ' ' LEU . 4.2 mm? -77.08 -29.39 54.97 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.224 -0.898 . . . . 75.21 111.359 178.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -67.22 -38.14 84.76 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.323 0.649 . . . . 62.03 109.973 178.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 67.3 mtm -62.07 -50.77 70.65 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 123.779 0.675 . . . . 75.02 111.019 -179.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 42' ' ' LEU . 4.4 pp -76.51 -22.77 54.0 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.698 0.399 . . . . 65.33 111.967 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -71.24 -41.15 70.51 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.608 0.763 . . . . 72.45 110.211 174.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -73.17 -43.73 61.02 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.909 0.884 . . . . 75.42 108.882 -177.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 -61.02 -47.71 85.17 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.028 1.331 . . . . 71.45 110.096 178.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 54.3 38.11 61.23 Favored Glycine 0 C--N 1.35 1.326 0 O-C-N 124.881 1.363 . . . . 40.32 115.069 173.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -86.95 77.65 9.17 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 122.659 0.384 . . . . 63.34 110.512 -175.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 27.3 ttm180 45.04 70.44 0.35 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.607 1.563 . . . . 75.14 113.017 169.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.1 m -87.58 126.28 34.84 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.937 0.495 . . . . 75.42 110.21 -176.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 47.3 t -80.64 118.42 72.32 Favored Pre-proline 0 CA--C 1.542 0.64 0 C-N-CA 123.493 0.717 . . . . 74.43 109.361 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -78.2 165.84 25.3 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.492 2.128 . . . . 73.31 111.774 175.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 31.1 t -150.08 153.96 37.31 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 108.12 -1.066 . . . . 61.33 108.12 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -62.74 -44.73 95.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 122.495 0.318 . . . . 71.01 110.875 -179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HD2' ' HB2' ' A' ' 115' ' ' LEU . 18.7 pttm -58.86 -37.28 76.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.388 0.675 . . . . 64.04 111.147 175.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.452 ' N ' ' HG3' ' A' ' 57' ' ' LYS . 2.8 tm? -70.94 -47.66 57.77 Favored 'General case' 0 C--N 1.352 0.686 0 C-N-CA 124.11 0.964 . . . . 64.24 109.392 -175.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 44.3 m -64.46 -40.57 95.95 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 124.08 0.862 . . . . 43.24 110.857 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.8 m -58.52 -49.11 78.58 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.788 0.835 . . . . 73.15 110.756 174.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.45 -41.09 98.64 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.722 0.809 . . . . 53.13 111.0 179.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.504 ' SD ' HD11 ' A' ' 112' ' ' LEU . 22.6 mmt -67.84 -33.62 75.13 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 123.668 0.787 . . . . 74.12 111.14 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -73.27 -35.88 66.26 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.544 0.737 . . . . 64.35 110.751 178.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 76.0 mtp180 -68.55 -41.04 80.37 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.278 0.631 . . . . 61.43 110.112 175.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.571 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 2.5 t80 -67.17 -45.91 75.56 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.116 1.366 . . . . 70.11 109.507 -177.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.2 ttpp -58.32 -51.29 70.4 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.812 -1.54 . . . . 72.03 110.009 175.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.72 -43.2 76.3 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.177 0.923 . . . . 52.32 111.392 -178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.572 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -61.8 -42.63 99.26 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 114.984 -1.007 . . . . 74.51 111.639 177.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 86.7 mt -74.41 -25.8 59.68 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.931 0.492 . . . . 72.33 112.3 179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 62.1 mt-10 -67.11 -44.04 80.95 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-O 121.619 0.724 . . . . 64.22 109.341 174.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 43.1 mt-10 -67.53 -43.18 81.39 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-N 114.509 -1.223 . . . . 62.24 111.01 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.57 -40.26 96.29 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.466 0.707 . . . . 62.2 111.23 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.42 -43.43 98.88 Favored 'General case' 0 C--N 1.351 0.64 0 O-C-N 124.235 0.959 . . . . 75.1 109.758 175.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -64.2 -33.34 86.98 Favored Glycine 0 C--N 1.352 1.428 0 CA-C-N 115.555 -0.748 . . . . 62.34 113.89 175.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 26.0 mm-40 -63.69 -57.94 8.45 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 109.998 -0.371 . . . . 73.14 109.998 178.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.563 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -66.7 -20.13 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 112.62 0.6 . . . . 74.3 112.62 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.74 -49.56 75.92 Favored 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 109.104 -0.702 . . . . 72.23 109.104 171.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -80.83 -25.97 37.36 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 111.811 0.3 . . . . 74.14 111.811 179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.563 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 16.7 m-30 -77.81 -5.21 50.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.595 0.758 . . . . 74.32 112.131 -178.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 96.8 p -55.91 -30.71 62.04 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.244 0.617 . . . . 74.42 110.178 173.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -81.76 107.55 14.58 Favored 'General case' 0 C--N 1.347 0.493 0 N-CA-C 108.657 -0.868 . . . . 62.43 108.657 167.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 9.5 mpt_? -68.26 -25.82 65.36 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.345 0.658 . . . . 75.2 110.749 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.7 p -71.23 -33.02 69.47 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.78 0.832 . . . . 43.15 111.336 175.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -62.95 -40.57 98.08 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.566 0.746 . . . . 65.23 110.047 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.65 HG23 HD11 ' A' ' 97' ' ' LEU . 32.3 mt -57.87 -61.25 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.355 0.846 0 CA-C-N 114.83 -1.077 . . . . 73.23 109.911 175.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 44.4 t -51.99 -40.57 61.15 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.976 0.91 . . . . 72.24 111.971 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 47.3 tpt85 -58.92 -56.68 19.11 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.449 -1.25 . . . . 63.21 111.754 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -77.85 -21.27 51.66 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 110.219 -0.289 . . . . 71.33 110.219 -177.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.505 HD23 HE22 ' A' ' 149' ' ' GLN . 17.3 tp -73.3 -40.81 64.24 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.932 0.893 . . . . 72.01 110.576 -173.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.8 t -67.11 -23.92 65.88 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.026 0.441 . . . . 53.54 110.607 174.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -99.33 -0.26 41.5 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.591 1.156 . . . . 71.24 111.8 178.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.6 t -66.55 131.05 45.18 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.279 0.632 . . . . 53.02 110.369 -176.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 69.0 mt-30 -81.78 -7.8 59.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.763 0.825 . . . . 64.42 111.294 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -136.36 -175.46 4.0 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.706 0.802 . . . . 52.05 110.158 -179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.11 -45.96 10.22 Favored 'General case' 0 C--O 1.242 0.689 0 C-N-CA 123.763 0.825 . . . . 72.11 110.909 178.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.6 HD13 ' HG2' ' A' ' 99' ' ' LYS . 3.1 mp -76.3 131.59 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 123.759 0.662 . . . . 74.33 109.825 -168.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.77 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.9 tp -62.97 -39.75 95.63 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.237 1.015 . . . . 74.31 111.096 -178.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.403 ' H ' HG22 ' A' ' 96' ' ' ILE . 39.1 m-85 -103.56 17.74 23.42 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 114.354 -1.294 . . . . 72.42 111.016 -175.656 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.6 ' HG2' HD13 ' A' ' 96' ' ' ILE . 2.1 tmtp? -35.45 -64.27 0.3 Allowed 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 124.78 1.232 . . . . 74.52 113.571 -157.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 104' ' ' LYS . 25.8 t70 -61.82 -48.84 78.77 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 124.044 0.84 . . . . 54.53 110.797 -175.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 53.1 t -62.19 -44.95 99.7 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.954 0 C-N-CA 123.826 0.85 . . . . 74.32 111.268 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 67.1 t30 -75.43 -25.93 57.9 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.599 0.76 . . . . 72.12 110.221 -175.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -65.65 -38.64 89.91 Favored 'General case' 0 C--N 1.349 0.564 0 N-CA-C 108.827 -0.805 . . . . 74.24 108.827 170.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 100' ' ' ASP . 1.4 mptm? -64.42 -40.49 95.87 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-O 118.855 -0.593 . . . . 72.04 110.846 172.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.572 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.5 mp -58.12 -43.76 87.38 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 119.275 0.943 . . . . 74.14 110.389 172.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.54 ' HB2' HH12 ' A' ' 34' ' ' ARG . 9.5 t -67.33 -51.62 50.16 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.421 0.688 . . . . 70.52 111.256 -175.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.433 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 14.0 t70 -69.26 -50.02 50.81 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 114.531 -1.213 . . . . 73.02 110.11 -174.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.56 -35.95 72.49 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.44 0 CA-C-O 118.944 -0.55 . . . . 75.03 110.806 -178.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.54 ' HH2' HG12 ' A' ' 124' ' ' VAL . 45.5 t-105 -60.6 -48.52 81.39 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 118.373 0.533 . . . . 73.23 110.567 176.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -66.42 -37.08 84.41 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 118.931 -0.557 . . . . 75.45 110.961 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.5 mm-40 -61.42 -48.23 82.15 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 118.265 0.484 . . . . 52.22 111.398 175.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.504 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.0 tt -64.79 -51.93 59.55 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.294 1.438 . . . . 65.43 109.733 -175.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 42.9 t -60.78 -42.24 97.13 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.802 1.241 . . . . 71.23 111.538 179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 36.9 mt -61.2 -55.88 27.1 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-O 119.342 -0.361 . . . . 65.44 110.86 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.548 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 4.5 pp -61.53 -29.82 70.24 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.579 0.228 . . . . 71.1 111.571 -177.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.558 HD22 ' SD ' ' A' ' 122' ' ' MET . 58.9 mt -62.42 -53.63 52.01 Favored 'General case' 0 C--N 1.359 0.99 0 CA-C-N 115.813 -0.63 . . . . 71.53 111.126 171.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -68.88 -35.1 76.48 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.979 0.512 . . . . 73.41 111.839 -175.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 70.0 t -71.61 -58.68 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 C-N-CA 123.183 0.593 . . . . 63.43 110.512 -177.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -97.05 -56.42 2.56 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.354 0.502 . . . . 64.34 112.354 -171.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 16.6 mm-40 -71.46 -14.87 62.27 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 112.128 0.418 . . . . 71.35 112.128 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 85.0 mtm180 60.53 23.53 13.22 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.842 1.257 . . . . 74.51 111.975 -178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.558 ' SD ' HD22 ' A' ' 116' ' ' LEU . 64.4 mtp -79.96 118.26 71.52 Favored Pre-proline 0 C--N 1.351 0.666 0 C-N-CA 124.408 1.083 . . . . 75.1 109.552 179.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -84.7 48.68 2.45 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 123.148 2.565 . . . . 62.34 111.882 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.54 HG12 ' HH2' ' A' ' 109' ' ' TRP . 51.5 t -91.32 80.33 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.346 0.429 0 C-N-CA 124.213 1.005 . . . . 74.23 109.514 -174.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 21.2 t -166.06 84.6 0.97 Allowed Pre-proline 0 C--O 1.242 0.709 0 CA-C-N 114.735 -1.12 . . . . 70.44 108.383 173.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_endo -79.03 35.8 0.58 Allowed 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 123.103 2.535 . . . . 63.0 112.214 176.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 8.4 tt -157.54 -52.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.79 0 C-N-CA 123.973 0.909 . . . . 73.54 110.472 -172.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 14.9 t 57.99 -148.79 0.47 Allowed 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.014 0.926 . . . . 75.54 109.536 -172.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.53 -89.28 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 123.968 0.907 . . . . 72.52 110.672 170.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 75.93 -26.3 1.45 Allowed Glycine 0 CA--C 1.545 1.916 0 N-CA-C 116.169 1.228 . . . . 42.11 116.169 170.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -81.59 -58.02 3.2 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 118.318 1.059 . . . . 50.11 111.62 -172.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 61.0 m -75.18 -12.68 60.35 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.425 0.69 . . . . 60.14 110.924 174.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 11.0 t90 -51.01 -54.77 21.61 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 124.955 1.302 . . . . 65.22 110.888 177.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -67.23 -20.63 65.71 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.793 0.837 . . . . 73.44 112.145 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 138' ' ' GLN . 67.3 mt-30 -77.68 -34.23 53.02 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.32 0.648 . . . . 70.44 110.27 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.511 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . 45.2 mt-10 -64.88 -42.19 95.01 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 109.236 -0.653 . . . . 73.44 109.236 173.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -56.52 -44.72 81.07 Favored 'General case' 0 N--CA 1.476 0.83 0 O-C-N 123.886 0.741 . . . . 74.14 111.836 178.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 135' ' ' GLN . 2.5 pt20 -76.17 -30.7 58.19 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.387 0.429 . . . . 64.43 111.58 -176.401 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -65.63 -53.05 46.88 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.654 0.782 . . . . 74.13 110.253 174.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.8 -46.88 77.91 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 114.534 -1.212 . . . . 71.35 111.221 175.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -68.2 -29.26 68.07 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 123.821 0.849 . . . . 22.54 112.808 -177.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.36 -49.62 66.29 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.157 0.503 . . . . 64.21 109.988 175.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -64.7 -31.69 73.03 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.382 -1.281 . . . . 72.04 111.605 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.7 t0 -79.55 -41.44 27.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.058 0.943 . . . . 71.33 111.509 -175.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 53.8 ttt180 -66.6 -37.16 84.32 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.529 0.731 . . . . 64.24 109.629 176.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -68.7 -35.64 77.45 Favored 'General case' 0 CA--C 1.545 0.785 0 CA-C-N 115.317 -0.856 . . . . 70.35 110.829 171.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -72.23 -23.96 61.31 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.664 0.386 . . . . 63.14 111.172 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.3 OUTLIER -79.7 -60.82 2.2 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.31 0.644 . . . . 63.4 110.011 178.928 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . 0.505 HE22 HD23 ' A' ' 89' ' ' LEU . 2.0 mp0 -71.03 -45.35 64.06 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.841 0.456 . . . . 73.21 111.186 -176.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 25.7 ttm -99.88 60.38 1.09 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.016 -1.105 . . . . 44.2 108.016 179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 30.9 tp -81.74 89.68 6.3 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-O 122.17 0.986 . . . . 72.22 109.311 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.84 25.97 5.58 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 113.564 -1.653 . . . . 62.13 108.767 176.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.59 ' HG2' ' H ' ' A' ' 154' ' ' ASP . 56.2 ttt180 -119.36 -163.65 1.0 Allowed 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 107.211 -1.403 . . . . 74.32 107.211 -177.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.59 ' H ' ' HG2' ' A' ' 153' ' ' ARG . 45.2 m-20 -54.9 105.82 0.18 Allowed 'General case' 0 C--N 1.356 0.869 0 CA-C-N 118.536 0.607 . . . . 61.14 109.931 166.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -77.5 -15.47 59.27 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.694 -0.685 . . . . 71.0 110.448 176.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 . . . . . 0 C--O 1.253 1.273 0 CA-C-O 118.714 -0.66 . . . . 75.32 110.419 178.111 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.529 ' SD ' ' HA ' ' A' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.376 0.131 . . . . 64.31 111.169 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -62.89 -28.9 70.36 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.898 0.879 . . . . 71.52 111.669 -178.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.21 -45.22 61.82 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.465 0.706 . . . . 73.13 110.314 172.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.413 ' O ' HD13 ' A' ' 8' ' ' ILE . 4.0 mm? -65.06 -41.56 95.01 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 115.153 -0.93 . . . . 70.34 110.675 179.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -57.82 -46.55 84.54 Favored 'General case' 0 N--CA 1.48 1.037 0 N-CA-C 109.605 -0.517 . . . . 65.41 109.605 -179.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -60.79 -55.46 32.88 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 123.757 0.66 . . . . 71.12 110.859 179.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 98.7 mt -57.42 -53.95 37.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.724 0.809 . . . . 73.42 112.167 -176.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.509 HD11 ' HB3' ' A' ' 42' ' ' LEU . 1.7 mp -61.07 -44.34 98.08 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.301 1.04 . . . . 72.31 110.511 -176.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 95.9 m -63.73 -46.38 85.64 Favored 'General case' 0 C--N 1.358 0.952 0 C-N-CA 122.88 0.472 . . . . 72.14 111.262 178.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -58.8 -46.28 87.94 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.466 0.706 . . . . 60.24 110.936 -178.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.419 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -58.2 -49.93 71.1 Favored Glycine 0 C--N 1.345 1.068 0 O-C-N 124.608 1.193 . . . . 64.55 111.966 178.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.4 ' O ' ' HD3' ' A' ' 16' ' ' LYS . 70.8 mt-30 -56.09 -46.72 78.95 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 122.962 0.505 . . . . 70.3 111.365 176.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 54.6 t -61.2 -38.32 79.48 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 123.789 0.836 . . . . 73.3 111.15 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 92.9 mt -61.25 -53.59 46.83 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 C-N-CA 123.771 0.828 . . . . 62.24 110.197 176.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -60.73 -33.05 72.32 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.848 0.859 . . . . 74.54 111.43 -177.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HD3' ' O ' ' A' ' 12' ' ' GLN . 1.7 mptm? -75.22 -53.17 9.25 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.293 0.637 . . . . 72.31 111.186 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.477 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 12.1 ptm180 -66.93 -30.44 70.58 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 111.753 0.279 . . . . 73.21 111.753 -175.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 28' ' ' CYS . 47.1 t -59.76 -17.89 38.93 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.861 1.264 . . . . 61.02 112.995 -175.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -53.32 -23.57 9.59 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.602 0.761 . . . . 60.34 112.332 173.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -67.72 -13.28 61.97 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 124.197 0.999 . . . . 71.54 112.066 -178.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.1 mmt -76.3 96.35 3.95 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 109.514 -0.551 . . . . 75.34 109.514 173.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -29.42 39.35 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.456 -0.942 . . . . 75.2 108.456 174.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.407 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 43.6 m-85 -99.97 175.99 5.58 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.439 1.096 . . . . 75.11 110.194 169.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' HG21 ' A' ' 85' ' ' ILE . 70.9 m 53.67 79.5 0.13 Allowed 'General case' 0 C--N 1.356 0.873 0 O-C-N 124.385 1.053 . . . . 64.11 110.138 -171.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -73.86 -61.21 1.93 Allowed 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.551 -0.749 . . . . 75.25 109.591 -170.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 48.8 mttm -67.15 -39.52 86.55 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 114.416 -1.266 . . . . 74.3 111.781 -174.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.462 ' HG2' HH22 ' A' ' 30' ' ' ARG . 45.7 mt-30 -71.22 -31.45 67.6 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.07 0.548 . . . . 53.13 111.84 -177.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.576 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 53.2 t -76.63 -40.79 48.17 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.315 0.646 . . . . 53.42 110.692 177.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 37.4 mtp-105 -65.39 -38.35 89.72 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.219 0.608 . . . . 74.24 110.657 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.629 HH22 ' HB2' ' A' ' 141' ' ' ALA . 6.5 mtp180 -66.44 -44.42 82.92 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-O 118.175 -0.917 . . . . 72.2 109.939 175.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.574 HD23 ' SG ' ' A' ' 18' ' ' CYS . 55.5 tp -56.08 -49.29 74.22 Favored 'General case' 0 N--CA 1.479 1.01 0 O-C-N 123.71 0.631 . . . . 72.33 110.776 178.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.36 -45.87 92.42 Favored Glycine 0 C--N 1.351 1.388 0 O-C-N 123.989 0.806 . . . . 53.5 112.166 177.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -60.93 -42.55 98.4 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.309 1.043 . . . . 74.52 111.49 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 30' ' ' ARG . 57.1 mtt180 -59.22 -61.04 2.93 Favored 'General case' 0 C--N 1.357 0.928 0 N-CA-C 108.7 -0.852 . . . . 75.4 108.7 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.3 t -51.09 -49.04 29.74 Favored 'Isoleucine or valine' 0 C--N 1.353 0.75 0 O-C-N 125.47 1.731 . . . . 55.03 111.636 -175.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 97.1 mt -61.12 -43.61 98.62 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 124.097 0.873 . . . . 62.03 111.063 179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.88 -25.59 74.18 Favored Glycine 0 CA--C 1.535 1.283 0 O-C-N 123.553 0.533 . . . . 51.13 113.354 176.536 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.518 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 20.0 mt -82.89 -43.12 16.93 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.204 0.602 . . . . 62.12 111.127 -177.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.419 HG21 ' HA3' ' A' ' 11' ' ' GLY . 12.1 pt -79.07 -30.98 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 CA-C-O 118.43 -0.795 . . . . 73.21 110.544 -177.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.528 ' HB3' ' HD3' ' A' ' 41' ' ' PRO . 57.2 tptt -43.07 -59.45 3.11 Favored Pre-proline 0 N--CA 1.494 1.772 0 C-N-CA 124.346 1.058 . . . . 74.4 113.127 -178.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 40' ' ' LYS . 26.0 Cg_exo -65.8 -31.62 47.98 Favored 'Trans proline' 0 C--N 1.392 2.835 0 C-N-CA 122.133 1.888 . . . . 74.42 112.609 -174.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.509 ' HB3' HD11 ' A' ' 8' ' ' ILE . 3.4 mm? -79.44 -25.06 42.06 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.415 0.686 . . . . 74.12 110.768 -178.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -73.01 -36.3 66.99 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.345 0.658 . . . . 74.14 109.324 172.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.434 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 30.7 mmt -63.79 -24.55 67.8 Favored 'General case' 0 N--CA 1.482 1.139 0 O-C-N 123.74 0.65 . . . . 64.33 110.529 175.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 77.2 mt -73.83 -64.01 1.09 Allowed 'General case' 0 C--N 1.355 0.814 0 N-CA-C 109.276 -0.639 . . . . 73.42 109.276 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -54.71 -34.65 62.71 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.182 0.808 . . . . 73.1 113.182 -167.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -73.39 -67.68 0.56 Allowed 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.403 0.281 . . . . 74.44 111.7 176.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -77.36 -59.11 2.92 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 120.69 0.281 . . . . 73.22 111.023 -174.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -86.34 63.69 4.12 Favored Glycine 0 C--N 1.344 0.977 0 CA-C-N 115.842 -0.617 . . . . 74.13 111.832 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.529 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 5.0 ttmp? -88.05 152.92 21.68 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 108.927 -0.768 . . . . 74.1 108.927 176.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 68.62 20.28 8.34 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 124.641 1.176 . . . . 63.33 111.444 -174.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.451 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 46.7 m -66.04 144.65 56.59 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 109.328 -0.619 . . . . 62.24 109.328 171.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 41.5 t -98.08 102.04 12.73 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.566 0.747 . . . . 71.13 109.082 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 52' ' ' SER . 8.2 Cg_exo -73.71 130.02 14.23 Favored 'Trans proline' 0 C--N 1.372 1.81 0 C-N-CA 122.568 2.179 . . . . 72.12 109.993 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 69.8 p -63.85 171.28 2.86 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 123.24 0.616 . . . . 52.0 110.326 174.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -58.85 -45.17 90.71 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 122.978 0.511 . . . . 70.32 111.126 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -70.79 -34.68 72.01 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.279 0.631 . . . . 65.41 111.867 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.562 HD22 HD13 ' A' ' 115' ' ' LEU . 0.3 OUTLIER -59.82 -49.26 78.42 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.182 -1.044 . . . . 73.14 108.182 176.681 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -64.98 -35.18 80.36 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.482 1.113 . . . . 61.45 111.014 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 83.2 m -59.33 -48.26 82.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 122.845 0.458 . . . . 73.34 110.54 176.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.98 -40.6 94.07 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.833 0.708 . . . . 73.21 110.98 176.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 14.3 mmt -61.97 -41.36 97.91 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.542 0.737 . . . . 73.21 111.836 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -69.78 -39.1 76.83 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.444 0.698 . . . . 65.42 110.719 -178.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -65.76 -37.96 87.79 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.408 0.683 . . . . 75.22 110.884 176.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 1.7 t80 -70.05 -43.49 71.14 Favored 'General case' 0 N--CA 1.472 0.635 0 O-C-N 123.882 0.739 . . . . 73.22 109.969 -177.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.0 tttm -58.99 -50.26 74.76 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.669 1.188 . . . . 65.5 110.825 176.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.91 -41.42 97.9 Favored 'General case' 0 C--N 1.348 0.542 0 O-C-N 124.019 0.824 . . . . 72.14 111.241 -179.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.433 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -63.88 -38.88 92.73 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 123.88 0.737 . . . . 42.11 111.169 179.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 73.5 mt -64.68 -43.71 92.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.084 0.554 . . . . 73.52 110.886 175.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -62.72 -34.02 76.31 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.451 0.701 . . . . 62.54 111.095 179.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 36.9 mm-40 -69.3 -42.93 74.78 Favored 'General case' 0 C--N 1.351 0.634 0 O-C-N 123.603 0.564 . . . . 72.14 111.349 175.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.56 -37.74 88.48 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.066 0.546 . . . . 44.43 111.173 177.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -60.36 -44.54 95.49 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.17 0.988 . . . . 61.32 109.641 172.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -62.11 -36.73 93.37 Favored Glycine 0 C--N 1.347 1.183 0 O-C-N 124.239 0.962 . . . . 74.0 112.916 176.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 18.2 mm-40 -62.75 -56.93 13.13 Favored 'General case' 0 C--N 1.351 0.645 0 CA-C-N 117.273 0.536 . . . . 63.41 110.16 178.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.417 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.9 pt -65.56 -18.98 24.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 112.169 0.433 . . . . 54.31 112.169 178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.477 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 27.2 tt0 -70.91 -39.91 72.45 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 122.691 0.396 . . . . 74.54 110.653 173.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 48.9 mttm -74.98 -30.23 61.12 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-O 120.899 0.381 . . . . 72.54 110.467 175.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 22.0 m-85 -81.36 0.03 39.12 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.662 0.785 . . . . 64.35 112.228 -178.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.6 p -55.75 -34.79 65.52 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-O 121.82 0.819 . . . . 61.34 110.955 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.484 ' HB2' ' ND2' ' A' ' 84' ' ' ASN . 21.6 m-80 -93.67 113.5 25.6 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.164 -1.421 . . . . 54.42 107.164 168.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -69.76 -21.53 63.43 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.941 0.896 . . . . 74.52 110.843 -171.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 27.3 m -63.13 -33.46 75.5 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.917 0.887 . . . . 72.21 111.691 173.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.484 ' ND2' ' HB2' ' A' ' 81' ' ' ASN . 88.3 m-20 -67.09 -38.3 85.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.264 0.626 . . . . 72.31 110.228 176.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.675 HG23 HD11 ' A' ' 97' ' ' LEU . 52.2 mt -55.72 -60.86 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.967 0 O-C-N 124.082 0.864 . . . . 74.23 109.197 172.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 52.7 t -53.82 -37.78 63.91 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.08 0.952 . . . . 35.34 111.63 -177.778 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.5 tpt180 -58.78 -57.54 12.58 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.429 1.08 . . . . 44.55 111.033 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -76.51 -28.2 56.31 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 110.366 -0.235 . . . . 75.34 110.366 -177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.414 HD23 HE22 ' A' ' 149' ' ' GLN . 16.7 tp -68.43 -39.7 81.43 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.454 1.102 . . . . 74.5 110.934 -171.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 7.9 t -65.26 -31.25 72.31 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.626 0.579 . . . . 73.31 110.956 -179.685 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.23 -1.26 31.58 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.833 0.853 . . . . 70.34 111.64 -177.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 t -70.38 131.08 43.57 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.493 0.717 . . . . 70.43 111.139 -175.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -97.25 -9.99 26.62 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.425 0.69 . . . . 65.14 109.764 168.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -71.44 -52.63 17.47 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.563 0.745 . . . . 63.4 109.611 179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.586 ' HD2' ' HA ' ' A' ' 142' ' ' ASP . 37.4 ttpt 80.31 -39.81 0.18 Allowed 'General case' 0 C--N 1.363 1.186 0 O-C-N 125.73 1.893 . . . . 63.44 111.684 -178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.605 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 4.2 mp -73.42 132.93 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 N-CA-C 107.696 -1.224 . . . . 62.25 107.696 165.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.675 HD11 HG23 ' A' ' 85' ' ' ILE . 10.9 tp -62.97 -29.6 70.94 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.062 0.945 . . . . 74.14 112.734 -172.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.441 ' H ' HG22 ' A' ' 96' ' ' ILE . 52.2 m-85 -120.33 8.63 10.85 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 117.999 -1.001 . . . . 71.45 111.211 -174.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.605 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 28.2 ttpt -35.68 -59.59 0.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 114.724 1.379 . . . . 44.34 114.724 -156.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 31.3 t70 -66.89 -42.98 84.61 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.63 0.772 . . . . 60.03 111.563 -175.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 61.9 t -67.59 -38.02 79.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.242 0.617 . . . . 65.32 110.179 179.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -80.27 -18.16 50.12 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.42 0.688 . . . . 61.42 110.233 -179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 5.6 tmm_? -73.68 -34.0 64.69 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.505 -0.924 . . . . 75.02 108.505 170.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.461 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 48.3 mttm -62.9 -46.47 87.68 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.482 -0.562 . . . . 72.14 109.482 170.01 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.433 HD22 ' HB1' ' A' ' 68' ' ' ALA . 3.8 mm? -56.23 -43.29 78.47 Favored 'General case' 0 N--CA 1.483 1.191 0 O-C-N 123.336 0.397 . . . . 63.25 110.902 173.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 33.1 t -70.46 -34.95 73.01 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.332 0.653 . . . . 50.41 111.332 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 110' ' ' LYS . 18.0 t70 -72.27 -55.53 7.03 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.982 0.913 . . . . 72.41 109.496 -176.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 55.6 t -56.87 -53.76 38.33 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.964 0 CA-C-N 114.907 -1.042 . . . . 74.43 109.598 177.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 61.2 t-105 -61.5 -37.97 85.61 Favored 'General case' 0 C--N 1.357 0.93 0 CA-C-O 118.364 -0.827 . . . . 75.2 112.831 -175.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 22.7 ptmt -65.39 -47.64 75.65 Favored 'General case' 0 N--CA 1.48 1.07 0 CA-C-N 119.556 1.071 . . . . 73.2 108.921 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.03 -35.59 80.98 Favored 'General case' 0 N--CA 1.481 1.083 0 CA-C-O 120.93 0.395 . . . . 60.1 110.899 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.427 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 7.3 tt -72.82 -44.42 61.5 Favored 'General case' 0 C--O 1.217 -0.647 0 C-N-CA 124.803 1.241 . . . . 62.14 110.023 -173.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.453 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 31.1 t -67.4 -40.93 85.66 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.349 0.66 . . . . 74.12 109.444 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 92.5 mt -64.13 -39.74 94.68 Favored 'General case' 0 C--N 1.358 0.953 0 O-C-N 123.504 0.502 . . . . 73.43 112.019 178.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.562 HD13 HD22 ' A' ' 58' ' ' LEU . 4.2 pp -73.88 -25.25 59.93 Favored 'General case' 0 N--CA 1.482 1.165 0 CA-C-N 118.064 0.393 . . . . 71.13 110.515 176.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.571 HD13 ' SD ' ' A' ' 122' ' ' MET . 89.8 mt -69.67 -32.01 70.4 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 119.61 -0.233 . . . . 72.12 110.393 171.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 113' ' ' SER . 24.0 mm-40 -67.21 -52.35 42.22 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 122.803 0.441 . . . . 65.41 110.063 176.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 89.3 t -76.26 -60.31 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.864 0 CA-C-N 115.326 -0.852 . . . . 63.3 111.384 -172.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -70.44 -56.23 7.12 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.763 0.425 . . . . 61.14 111.239 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -95.97 -11.55 26.37 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.267 0.84 . . . . 64.01 113.267 -168.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 55.28 71.41 0.54 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.809 0.844 . . . . 74.14 111.393 -175.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.571 ' SD ' HD13 ' A' ' 116' ' ' LEU . 55.7 ttm -104.84 123.5 39.82 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 122.997 0.519 . . . . 71.32 110.115 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -82.39 76.3 4.24 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 122.499 2.133 . . . . 75.05 112.396 175.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 31.9 m -73.54 136.43 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.84 0 N-CA-C 109.302 -0.629 . . . . 72.01 109.302 172.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.44 ' H ' ' HD2' ' A' ' 126' ' ' PRO . 33.1 t -141.6 -46.28 0.02 OUTLIER Pre-proline 0 CA--C 1.556 1.191 0 CA-C-O 118.005 -0.998 . . . . 72.15 112.361 -173.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.44 ' HD2' ' H ' ' A' ' 125' ' ' SER . 87.7 Cg_exo -52.26 -45.74 37.38 Favored 'Trans proline' 0 C--N 1.397 3.094 0 C-N-CA 122.054 1.836 . . . . 64.14 112.615 171.001 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 11.4 tt -144.15 143.93 23.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 N-CA-C 108.681 -0.859 . . . . 75.41 108.681 176.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 23.6 m -145.26 -59.57 0.34 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 122.99 0.516 . . . . 72.42 110.67 -175.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.425 ' OE1' ' HB3' ' A' ' 131' ' ' ALA . 0.3 OUTLIER -77.11 -49.55 15.02 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.192 0.997 . . . . 75.53 109.386 -173.486 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 86.84 -28.2 5.57 Favored Glycine 0 C--N 1.349 1.282 0 N-CA-C 114.94 0.736 . . . . 53.23 114.94 170.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.425 ' HB3' ' OE1' ' A' ' 129' ' ' GLN . . . -72.93 -14.7 61.51 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 117.551 0.675 . . . . 44.23 112.706 -174.772 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.7 t -61.53 -21.67 64.46 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 122.989 0.516 . . . . 64.23 111.421 176.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 36.2 m0 -54.61 -43.23 72.05 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.614 0.765 . . . . 72.51 111.057 172.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.77 -19.93 60.29 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 112.51 0.559 . . . . 55.22 112.51 -177.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -91.41 -60.68 1.83 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.868 0.867 . . . . 64.24 110.783 170.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -55.48 -62.68 1.52 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.785 1.234 . . . . 74.41 111.55 -176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.69 66.82 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.344 -1.298 . . . . 75.32 111.527 -176.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.435 ' HA ' HD11 ' A' ' 96' ' ' ILE . 36.2 tt0 -72.34 -56.21 5.86 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 123.65 0.594 . . . . 72.12 111.601 -177.57 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.422 ' O ' ' HB3' ' A' ' 142' ' ' ASP . 13.5 mm100 -69.22 -28.03 66.0 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.729 0.643 . . . . 74.54 111.407 -176.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -86.74 -28.46 23.04 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.952 -0.567 . . . . 43.54 110.593 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.629 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -72.34 -26.56 61.97 Favored 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 109.825 -0.435 . . . . 73.45 109.825 168.102 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.586 ' HA ' ' HD2' ' A' ' 95' ' ' LYS . 25.5 t70 -62.58 -52.66 62.53 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 123.933 0.77 . . . . 53.35 108.941 172.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -60.87 -37.27 81.56 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.603 1.19 . . . . 74.14 113.138 174.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.48 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 20.9 t0 -76.94 -46.28 24.74 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.022 0.378 . . . . 72.21 112.022 -174.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.467 ' HD3' ' HG3' ' A' ' 95' ' ' LYS . 78.5 ttt180 -63.41 -36.54 84.06 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.492 0.717 . . . . 64.42 110.487 173.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -57.33 -47.21 82.17 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 115.565 -0.743 . . . . 72.42 109.507 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.35 -32.8 74.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 124.168 0.917 . . . . 75.22 111.889 178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.407 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 1.1 t80 -65.24 -43.14 92.36 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.237 0.615 . . . . 73.51 109.854 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . 0.414 HE22 HD23 ' A' ' 89' ' ' LEU . 1.9 mp0 -85.07 -20.34 30.54 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.136 0.574 . . . . 71.44 111.645 179.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 15.6 tmm? -79.67 -62.69 1.61 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.03 0.532 . . . . 62.5 109.933 -178.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 92.9 mt 46.26 109.51 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 126.277 1.831 . . . . 72.14 113.619 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 46.8 ttp180 -106.21 77.75 1.25 Allowed 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.516 -0.92 . . . . 71.41 108.516 -176.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -161.25 -87.12 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 CA-C-N 115.15 -0.932 . . . . 72.42 109.367 -179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -148.76 115.55 6.0 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 107.731 -1.211 . . . . 54.24 107.731 175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -108.82 128.99 55.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.441 0.696 . . . . 64.04 110.598 -173.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 . . . . . 0 CA--C 1.549 0.914 0 C-N-CA 123.822 0.849 . . . . 74.21 109.117 -179.177 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.414 ' SD ' ' O ' ' A' ' 1' ' ' MET . 11.8 tmm? . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 119.438 -0.315 . . . . 54.24 110.914 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -59.7 -35.25 74.13 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 118.167 0.44 . . . . 61.23 111.93 -172.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -61.96 -32.52 72.96 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 122.949 0.499 . . . . 72.22 111.338 177.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.479 ' O ' ' HB ' ' A' ' 7' ' ' ILE . 5.9 tt -68.3 -39.64 81.99 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.391 0.676 . . . . 52.14 109.363 174.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -68.13 -29.85 68.85 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 122.199 0.2 . . . . 45.52 110.802 175.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 60.7 m-70 -70.59 -34.74 72.5 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 119.159 -0.448 . . . . 72.01 110.416 174.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.479 ' HB ' ' O ' ' A' ' 4' ' ' LEU . 61.2 mt -56.26 -47.88 80.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 123.679 0.792 . . . . 61.44 110.085 169.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 36.2 mm -59.36 -46.93 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 CA-C-N 115.249 -0.887 . . . . 65.23 111.16 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.431 ' O ' HG23 ' A' ' 13' ' ' VAL . 87.2 m -60.8 -47.46 86.23 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.876 0.871 . . . . 62.31 110.757 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.8 mt -57.81 -50.62 72.67 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 123.948 0.78 . . . . 72.43 110.76 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.06 -35.05 91.5 Favored Glycine 0 C--N 1.348 1.248 0 O-C-N 124.602 1.189 . . . . 43.35 113.487 -178.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 tp-100 -72.39 -39.71 67.79 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 122.686 0.395 . . . . 65.4 110.194 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.48 HG12 HD21 ' A' ' 73' ' ' ASN . 98.6 t -72.96 -26.73 23.55 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 C-N-CA 123.275 0.63 . . . . 44.41 110.257 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.583 HG21 HG21 ' A' ' 35' ' ' VAL . 26.4 mt -60.13 -53.49 47.94 Favored 'Isoleucine or valine' 0 C--N 1.361 1.068 0 N-CA-C 108.897 -0.779 . . . . 70.22 108.897 171.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -57.23 -41.09 78.86 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.321 1.013 . . . . 74.12 110.94 178.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -53.84 -59.64 4.36 Favored 'General case' 0 N--CA 1.477 0.9 0 O-C-N 124.169 0.918 . . . . 74.0 112.103 177.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 13' ' ' VAL . 9.4 ptp180 -84.13 -16.56 43.16 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 113.703 1.001 . . . . 74.22 113.703 -172.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 52.6 t -63.51 -20.55 65.7 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.952 0.901 . . . . 74.11 111.952 178.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -58.46 -19.48 37.11 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 113.269 0.84 . . . . 65.5 113.269 178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -67.19 -20.2 65.68 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.804 0.668 . . . . 70.02 112.804 179.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.3 mmt -79.12 85.4 5.02 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.251 0.548 . . . . 73.11 110.752 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -75.21 -33.87 61.43 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.609 -1.256 . . . . 55.31 107.609 166.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.512 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 46.4 m-85 -92.33 162.87 14.09 Favored 'General case' 0 C--O 1.243 0.732 0 CA-C-N 114.619 -1.173 . . . . 71.23 110.37 173.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 68.9 m 54.32 65.55 1.48 Allowed 'General case' 0 C--N 1.354 0.766 0 O-C-N 124.636 1.21 . . . . 44.31 109.637 -170.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 26' ' ' LYS . 49.4 pttt -53.22 -50.07 65.48 Favored 'General case' 0 C--N 1.356 0.889 0 CA-C-N 114.771 -1.104 . . . . 72.22 110.524 -174.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.472 ' HG3' ' HG3' ' A' ' 25' ' ' LYS . 5.5 mtpm? -80.77 -25.43 37.95 Favored 'General case' 0 C--O 1.21 -0.987 0 CA-C-O 118.349 -0.834 . . . . 53.52 111.322 -172.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.833 ' HG3' ' HB2' ' A' ' 97' ' ' LEU . 18.1 mm-40 -70.56 -36.33 73.57 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 119.196 0.907 . . . . 74.41 109.775 175.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 49.0 t -67.08 -45.81 76.17 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.768 0.827 . . . . 44.52 110.359 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -72.84 -33.4 66.13 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 115.327 -0.851 . . . . 72.53 111.238 -179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.677 HH22 ' HB2' ' A' ' 141' ' ' ALA . 16.6 ttm180 -69.99 -45.81 66.5 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 109.462 -0.57 . . . . 72.23 109.462 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.438 HD21 HD13 ' A' ' 76' ' ' ILE . 41.8 tp -62.89 -46.14 89.26 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 124.114 0.884 . . . . 74.14 109.696 -179.182 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.52 -47.3 91.4 Favored Glycine 0 C--N 1.346 1.086 0 O-C-N 123.723 0.639 . . . . 72.22 112.614 177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 t-80 -60.67 -49.74 76.32 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.71 0.804 . . . . 63.43 111.12 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.534 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 17.1 mtt180 -61.66 -64.12 1.04 Allowed 'General case' 0 C--O 1.219 -0.501 0 CA-C-N 114.754 -1.112 . . . . 70.41 109.955 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.583 HG21 HG21 ' A' ' 14' ' ' ILE . 61.2 t -56.07 -46.73 80.94 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 124.14 0.9 . . . . 74.53 111.929 -171.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 10.7 mp -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 123.232 0.332 . . . . 73.44 110.502 176.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -69.0 -20.0 74.26 Favored Glycine 0 CA--C 1.537 1.442 0 N-CA-C 114.307 0.483 . . . . 71.21 114.307 177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 49.5 mt -87.23 -46.82 9.38 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.504 0.722 . . . . 71.05 110.792 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 12.4 pt -77.75 -38.9 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-O 118.925 -0.56 . . . . 74.11 111.482 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -56.48 -46.06 99.86 Favored Pre-proline 0 N--CA 1.487 1.386 0 N-CA-C 113.795 1.035 . . . . 72.52 113.795 -171.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -54.44 -51.67 9.98 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 121.581 1.521 . . . . 74.11 111.276 172.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -62.77 -31.28 72.22 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 115.452 -0.794 . . . . 72.11 111.662 -178.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 39' ' ' ILE . 44.9 mt-10 -66.44 -60.5 2.68 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.748 0.819 . . . . 75.51 110.576 178.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.2 ptp -61.11 -36.33 79.43 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 124.111 0.882 . . . . 71.43 111.455 -174.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.606 HD13 ' SD ' ' A' ' 122' ' ' MET . 82.9 mt -67.42 -47.59 69.78 Favored 'General case' 0 C--N 1.348 0.509 0 C-N-CA 123.504 0.721 . . . . 74.42 110.305 177.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -61.57 -35.07 76.75 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 123.811 0.694 . . . . 74.43 111.727 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -64.5 -37.9 89.16 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.085 0.554 . . . . 61.32 111.437 -179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.18 -46.91 13.14 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.574 0.75 . . . . 73.12 110.522 -177.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -166.37 146.94 11.43 Favored Glycine 0 C--N 1.347 1.145 0 CA-C-N 116.337 -0.392 . . . . 52.2 112.783 -175.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.53 161.75 17.61 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.682 0.793 . . . . 62.0 109.392 -179.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -113.54 98.06 6.83 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.167 0.587 . . . . 72.35 109.697 175.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.0 m -80.03 150.2 30.45 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.05 0.54 . . . . 71.34 110.141 174.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 39.1 t 60.58 73.01 0.66 Allowed Pre-proline 0 CA--C 1.557 1.218 0 C-N-CA 125.003 1.321 . . . . 62.22 110.068 -170.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -83.5 174.58 8.76 Favored 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.741 2.294 . . . . 71.12 111.781 174.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 81.1 p -86.59 178.5 7.04 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.89 0.376 . . . . 42.33 110.952 178.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.56 -33.95 76.72 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 115.127 -0.942 . . . . 73.13 110.228 172.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.612 ' HB3' HD22 ' A' ' 115' ' ' LEU . 35.7 mtmm -58.1 -55.18 38.26 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.589 0.756 . . . . 71.11 110.573 174.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.563 HD22 HD13 ' A' ' 115' ' ' LEU . 4.4 mm? -59.82 -49.38 77.92 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.646 0.778 . . . . 74.33 111.537 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 59.8 m -58.41 -50.42 73.74 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 123.931 0.769 . . . . 73.3 111.206 -178.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 60.6 m -68.82 -36.51 78.31 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.319 0.648 . . . . 62.52 111.53 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.405 ' HB2' HD21 ' A' ' 115' ' ' LEU . . . -68.79 -44.24 74.0 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.645 -0.502 . . . . 63.34 109.645 -177.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -40.33 96.66 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.987 -1.006 . . . . 64.23 111.44 178.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -66.83 -42.49 85.72 Favored 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 123.202 0.601 . . . . 73.11 111.538 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 71.1 mtp85 -69.15 -42.15 76.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.62 0.768 . . . . 73.25 111.027 -179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.413 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 20.1 t80 -71.03 -37.79 72.6 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.132 0.973 . . . . 73.44 110.102 -177.371 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 23.5 ttpp -61.75 -51.19 69.37 Favored 'General case' 0 C--N 1.35 0.59 0 CA-C-N 115.289 -0.868 . . . . 73.01 109.077 174.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -55.66 -41.31 73.45 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 124.17 0.919 . . . . 75.15 111.713 179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.597 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -62.27 -43.41 98.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 114.967 -1.015 . . . . 63.23 111.746 177.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 89.8 mt -75.79 -25.96 56.86 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.171 0.588 . . . . 61.24 112.214 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 52.8 mt-10 -65.74 -45.77 81.36 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.215 0.606 . . . . 74.11 109.404 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.17 -39.25 78.85 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.637 -1.165 . . . . 74.22 111.011 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.462 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -64.08 -43.37 95.62 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 123.5 0.5 . . . . 52.24 110.736 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.48 HD21 HG12 ' A' ' 13' ' ' VAL . 11.3 t-20 -61.59 -46.73 88.62 Favored 'General case' 0 C--N 1.352 0.688 0 O-C-N 124.547 1.154 . . . . 62.12 109.734 179.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -61.22 -42.11 99.69 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.081 -0.963 . . . . 73.34 112.446 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -59.41 -53.15 61.44 Favored 'General case' 0 C--N 1.349 0.577 0 CA-C-O 118.931 -0.557 . . . . 65.42 111.667 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.472 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.2 pt -65.71 -28.68 44.78 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 N-CA-C 112.446 0.536 . . . . 71.03 112.446 178.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -64.64 -33.13 75.22 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.444 0.298 . . . . 61.32 110.687 172.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 42.2 mttm -85.5 -28.09 25.2 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.021 0.529 . . . . 71.45 111.012 176.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.472 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 12.3 m-85 -76.67 -2.84 34.84 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.935 0.894 . . . . 61.14 112.135 -179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 83.8 p -57.69 -25.32 60.11 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.346 0.659 . . . . 73.0 110.378 170.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -84.46 107.29 16.63 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 107.712 -1.218 . . . . 61.54 107.712 164.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -72.91 -23.65 60.73 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.469 0.708 . . . . 63.12 110.736 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.2 p -68.73 -35.23 76.87 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.128 0.971 . . . . 73.21 111.335 170.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -61.4 -41.6 97.4 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.79 0.836 . . . . 74.21 110.236 173.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.615 HG23 HD11 ' A' ' 97' ' ' LEU . 39.3 mt -56.89 -60.15 2.31 Favored 'Isoleucine or valine' 0 C--N 1.354 0.794 0 CA-C-N 115.109 -0.95 . . . . 74.54 109.479 174.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 22.2 t -58.27 -34.51 70.58 Favored 'General case' 0 CA--C 1.552 1.032 0 O-C-N 123.964 0.79 . . . . 53.0 111.631 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 22.1 tpp180 -59.63 -56.45 21.79 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.977 1.311 . . . . 73.25 110.885 178.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -79.91 -22.23 42.99 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-N 116.853 -0.158 . . . . 75.24 110.583 -177.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 15.2 tp -76.27 -33.96 59.12 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.58 0.752 . . . . 64.34 111.081 -172.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.3 t -68.95 -25.05 64.36 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 110.065 -0.346 . . . . 61.3 110.065 173.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -107.82 17.62 22.29 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.433 1.093 . . . . 61.12 111.326 178.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 91.3 p -67.69 113.24 5.31 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 109.276 -0.638 . . . . 65.31 109.276 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -70.88 -13.01 61.87 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 115.263 -0.88 . . . . 61.05 111.167 -176.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -118.44 -100.13 0.44 Allowed 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 107.419 -1.326 . . . . 63.23 107.419 167.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.468 ' HG3' HD12 ' A' ' 96' ' ' ILE . 14.9 pttm 175.54 -25.82 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 125.332 1.453 . . . . 72.53 110.335 -176.676 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.468 HD12 ' HG3' ' A' ' 95' ' ' LYS . 3.6 mp -72.17 131.18 35.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 N-CA-C 108.985 -0.746 . . . . 71.25 108.985 176.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.833 ' HB2' ' HG3' ' A' ' 27' ' ' GLN . 11.0 tp -60.6 -40.67 92.65 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 121.694 0.759 . . . . 44.15 111.968 -171.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.421 ' HB3' ' HB ' ' A' ' 101' ' ' VAL . 5.0 m-85 -112.02 38.03 2.8 Favored 'General case' 0 C--O 1.21 -0.981 0 CA-C-N 114.992 -1.004 . . . . 73.42 108.528 -178.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' A' ' 100' ' ' ASP . 0.0 OUTLIER -39.49 -53.53 2.05 Favored 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 113.568 0.951 . . . . 74.12 113.568 -160.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.547 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 34.6 t70 -80.07 -40.7 27.09 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 123.372 0.669 . . . . 73.42 110.74 -177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.421 ' HB ' ' HB3' ' A' ' 98' ' ' PHE . 56.3 t -62.91 -54.43 33.73 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.644 0.777 . . . . 62.35 111.371 -177.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -69.45 -26.06 64.4 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 124.034 0.934 . . . . 70.33 111.213 176.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.73 -35.75 77.14 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.105 0.412 . . . . 73.42 110.993 164.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.547 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.9 mttm -66.01 -44.79 83.72 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 109.221 -0.659 . . . . 74.41 109.221 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.597 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.8 mp -53.47 -44.89 69.31 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 123.354 0.409 . . . . 71.23 109.972 174.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.42 ' HA ' ' CZ3' ' A' ' 133' ' ' TRP . 21.1 m -62.88 -57.64 10.12 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.776 0.673 . . . . 75.31 112.108 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.659 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 30.1 t70 -72.43 -41.71 65.87 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-N 114.865 -1.061 . . . . 51.14 110.692 -169.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 51.4 t -74.2 -28.79 23.7 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 CA-C-N 115.862 -0.608 . . . . 61.12 110.882 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.409 ' CD2' HD22 ' A' ' 38' ' ' LEU . 62.5 t-105 -67.83 -37.91 82.54 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-N 118.37 0.532 . . . . 72.43 110.439 172.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.659 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.7 mtpt -55.12 -52.73 62.33 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.523 -0.547 . . . . 75.11 109.523 173.357 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.49 ' O ' ' HG ' ' A' ' 114' ' ' LEU . 39.7 mt-10 -53.74 -51.73 62.39 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 124.424 1.078 . . . . 71.31 111.028 174.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.604 ' O ' ' HG ' ' A' ' 116' ' ' LEU . 0.7 OUTLIER -66.06 -55.24 17.58 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.054 0.942 . . . . 73.02 109.651 -168.464 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.2 p -59.63 -40.34 87.32 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.394 0.678 . . . . 74.41 112.0 179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 2.7 pp -64.08 -43.01 96.71 Favored 'General case' 0 C--N 1.37 1.457 0 CA-C-N 118.139 0.427 . . . . 71.53 110.839 -179.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.612 HD22 ' HB3' ' A' ' 57' ' ' LYS . 4.2 pp -74.6 -20.99 59.71 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.476 0.547 . . . . 53.11 112.476 177.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 112' ' ' LEU . 43.0 mt -69.42 -36.78 77.03 Favored 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 110.041 -0.355 . . . . 75.02 110.041 171.351 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.504 HE21 ' HA ' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -78.02 -38.34 44.92 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 123.321 0.648 . . . . 74.24 111.419 178.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 49.9 t -74.57 -62.63 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 123.339 0.656 . . . . 63.11 111.138 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -89.8 -57.11 2.98 Favored 'General case' 0 N--CA 1.475 0.78 0 O-C-N 122.383 -0.198 . . . . 64.01 111.382 -172.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 31.7 mm-40 -67.12 -23.19 65.79 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 123.638 0.586 . . . . 62.21 111.899 -172.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 56.89 32.22 21.07 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 124.332 1.053 . . . . 72.03 111.848 179.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.606 ' SD ' HD13 ' A' ' 45' ' ' LEU . 41.4 mtm -91.29 146.17 32.91 Favored Pre-proline 0 N--CA 1.467 0.422 0 N-CA-C 108.818 -0.808 . . . . 72.45 108.818 175.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -84.78 39.59 0.76 Allowed 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 123.06 2.507 . . . . 71.11 112.287 -173.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 39.9 t -81.11 90.48 1.83 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.684 0 C-N-CA 123.846 0.858 . . . . 73.44 109.98 -175.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 41.6 t -143.35 73.68 17.57 Favored Pre-proline 0 CA--C 1.546 0.804 0 CA-C-N 114.603 -1.18 . . . . 62.43 108.816 174.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -89.42 23.37 0.73 Allowed 'Trans proline' 0 C--N 1.38 2.23 0 C-N-CA 123.342 2.695 . . . . 73.1 111.776 174.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.5 tt -156.29 144.52 11.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 C-N-CA 124.276 1.03 . . . . 71.52 108.933 -172.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 26.3 m -82.39 85.04 6.97 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.475 0.71 . . . . 63.33 109.702 176.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 72.44 -69.27 0.19 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 125.567 1.547 . . . . 72.34 111.321 175.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.79 5.82 7.44 Favored Glycine 0 N--CA 1.471 1.02 0 CA-C-O 119.481 -0.622 . . . . 45.23 114.221 178.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.28 -37.08 66.39 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 117.38 0.59 . . . . 75.34 110.489 172.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 21.9 m -68.83 -20.35 64.3 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 115.171 -0.922 . . . . 63.4 112.662 -177.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.42 ' CZ3' ' HA ' ' A' ' 106' ' ' SER . 0.0 OUTLIER -60.17 -31.38 70.06 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.632 0.773 . . . . 74.05 111.558 -179.629 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -65.76 -32.33 73.82 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.697 0.399 . . . . 74.43 111.424 178.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . 0.431 ' O ' ' HG3' ' A' ' 138' ' ' GLN . 46.7 mt-30 -84.12 -37.87 21.43 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.775 0.83 . . . . 75.34 110.838 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -58.85 -52.65 64.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.42 1.088 . . . . 74.43 110.73 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.69 -37.28 86.02 Favored 'General case' 0 C--O 1.239 0.506 0 O-C-N 124.665 1.228 . . . . 65.33 112.907 -174.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . 0.431 ' HG3' ' O ' ' A' ' 135' ' ' GLN . 0.0 OUTLIER -68.73 -48.68 63.18 Favored 'General case' 0 C--N 1.352 0.682 0 N-CA-C 109.922 -0.399 . . . . 75.24 109.922 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -63.37 -37.9 89.08 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 121.298 0.571 . . . . 74.13 111.441 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.13 -49.54 76.82 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 124.408 1.083 . . . . 55.51 109.722 177.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.677 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.51 -21.14 59.7 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.074 -0.966 . . . . 72.12 112.052 -178.703 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -64.81 -54.41 31.62 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.89 -0.781 . . . . 74.3 108.89 173.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.27 -39.35 92.49 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 124.269 0.981 . . . . 71.12 110.502 -176.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.467 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 39.5 t0 -74.37 -48.52 27.5 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.661 -0.699 . . . . 70.54 112.163 -174.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 36.6 ttt-85 -65.65 -34.37 78.06 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.527 -0.546 . . . . 75.35 109.527 179.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -57.96 -48.68 79.25 Favored 'General case' 0 C--N 1.356 0.873 0 O-C-N 123.603 0.565 . . . . 75.51 109.648 171.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.12 -37.58 77.58 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 123.885 0.741 . . . . 73.23 111.8 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.512 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.9 OUTLIER -72.98 -49.18 30.56 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.612 0.57 . . . . 75.02 110.448 -178.722 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -81.55 -10.68 59.4 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 115.757 -0.656 . . . . 72.05 111.765 -172.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . 0.628 ' SD ' ' HB2' ' A' ' 152' ' ' ARG . 1.5 tmt? -96.24 -59.82 1.75 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.144 -1.058 . . . . 63.04 108.144 173.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.539 HD12 ' HB2' ' A' ' 155' ' ' ASN . 0.1 OUTLIER 40.81 65.69 0.75 Allowed 'General case' 0 N--CA 1.498 1.944 0 C-N-CA 125.957 1.703 . . . . 61.53 112.341 174.215 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . 0.628 ' HB2' ' SD ' ' A' ' 150' ' ' MET . 2.0 tmt_? -101.0 -23.47 14.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 108.52 -0.919 . . . . 75.11 108.52 -179.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 5.3 mmp_? -43.78 -49.15 8.14 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.425 1.49 . . . . 70.54 112.001 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -171.68 109.86 0.28 Allowed 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.382 1.051 . . . . 45.24 109.969 169.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.539 ' HB2' HD12 ' A' ' 151' ' ' LEU . 50.3 t30 -150.99 104.19 3.12 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.6 0.76 . . . . 74.14 109.451 178.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 . . . . . 0 CA--C 1.557 1.213 0 C-N-CA 125.645 1.578 . . . . 51.11 112.336 176.268 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 121.638 0.733 . . . . 62.52 110.106 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -69.78 -42.87 73.21 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.216 1.006 . . . . 74.22 110.179 -175.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.515 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 95.7 m-20 -58.45 -46.69 86.05 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.667 -0.697 . . . . 75.04 110.342 174.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.481 ' O ' HG12 ' A' ' 8' ' ' ILE . 42.6 mt -63.78 -40.49 96.8 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 123.863 0.727 . . . . 54.21 111.134 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -59.52 -48.42 81.72 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.762 -0.829 . . . . 62.51 108.762 -179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.6 m-70 -66.08 -49.12 68.69 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-O 118.901 -0.571 . . . . 73.13 111.118 -178.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.2 mt -54.42 -47.65 69.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.831 0.852 . . . . 62.14 111.275 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 4' ' ' LEU . 20.8 mm -66.78 -46.74 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-N 115.166 -0.925 . . . . 74.1 110.958 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 86.6 m -63.19 -44.0 96.59 Favored 'General case' 0 N--CA 1.478 0.932 0 O-C-N 123.536 0.522 . . . . 71.53 110.646 -179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.8 mt -55.49 -58.93 5.73 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.41 0.684 . . . . 72.54 109.835 176.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -61.81 -38.33 95.78 Favored Glycine 0 C--N 1.348 1.245 0 O-C-N 124.443 1.089 . . . . 61.24 114.609 -175.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -70.98 -47.65 57.72 Favored 'General case' 0 C--O 1.255 1.349 0 C-N-CA 123.192 0.597 . . . . 61.05 110.259 -177.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.44 HG12 ' HD2' ' A' ' 17' ' ' ARG . 90.6 t -64.48 -31.35 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 CA-C-N 115.631 -0.713 . . . . 71.2 110.01 174.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.582 HG12 HD11 ' A' ' 76' ' ' ILE . 14.5 mt -59.02 -49.89 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 C-N-CA 123.946 0.899 . . . . 35.42 109.712 174.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -60.44 -42.49 96.21 Favored 'General case' 0 CA--C 1.54 0.584 0 O-C-N 123.946 0.779 . . . . 74.53 111.322 -178.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -67.11 -58.04 5.64 Favored 'General case' 0 N--CA 1.483 1.18 0 O-C-N 123.309 0.381 . . . . 73.52 111.456 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.44 ' HD2' HG12 ' A' ' 13' ' ' VAL . 1.4 ptm180 -72.07 -19.78 61.77 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.742 0.817 . . . . 71.42 112.992 -167.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 35.1 t -61.66 -16.04 45.22 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.919 0.888 . . . . 61.4 112.059 176.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -55.01 -12.81 0.92 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 114.006 1.113 . . . . 74.42 114.006 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -66.24 -18.73 65.53 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.381 0.673 . . . . 74.32 112.609 176.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.505 ' HG2' ' O ' ' A' ' 18' ' ' CYS . 7.7 mmt -70.55 93.64 0.92 Allowed 'General case' 0 N--CA 1.477 0.904 0 CA-C-O 121.081 0.467 . . . . 75.51 110.716 -175.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.569 ' HB2' ' HG2' ' A' ' 82' ' ' ARG . 11.3 mmmm -68.76 -43.93 74.76 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.016 0.926 . . . . 73.11 110.252 171.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -101.97 175.05 5.67 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 113.833 -1.531 . . . . 55.34 109.546 166.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.494 ' SG ' HG21 ' A' ' 85' ' ' ILE . 83.5 m 58.52 45.04 16.99 Favored 'General case' 0 C--O 1.243 0.735 0 O-C-N 124.095 0.872 . . . . 71.33 110.844 -179.594 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -74.37 -45.23 48.3 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 114.627 -1.169 . . . . 72.42 110.658 -174.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.499 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 6.9 mtpm? -65.07 -33.5 76.17 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 109.07 -0.715 . . . . 75.1 109.07 -179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.463 ' HB2' ' OD1' ' A' ' 144' ' ' ASP . 3.1 tp-100 -55.41 -47.02 76.56 Favored 'General case' 0 C--N 1.359 0.998 0 O-C-N 123.893 0.746 . . . . 64.0 110.492 170.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.623 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 42.5 t -73.98 -21.97 59.8 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.201 1.0 . . . . 74.52 112.031 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -45.78 53.73 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.426 0.691 . . . . 64.45 109.739 174.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.448 ' NH2' ' HB2' ' A' ' 141' ' ' ALA . 21.9 ttp85 -75.33 -39.32 59.54 Favored 'General case' 0 C--O 1.221 -0.402 0 CA-C-N 115.456 -0.793 . . . . 71.54 110.856 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 43.7 tp -62.86 -44.44 96.13 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 108.826 -0.805 . . . . 71.41 108.826 174.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.21 -52.67 47.98 Favored Glycine 0 C--N 1.349 1.267 0 O-C-N 124.384 1.053 . . . . 74.42 112.025 175.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -69.45 -34.12 73.93 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.092 0.557 . . . . 54.33 112.424 -177.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.656 HH12 ' HB2' ' A' ' 106' ' ' SER . 14.4 mtt180 -65.45 -58.81 4.92 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.092 -0.707 . . . . 61.3 109.092 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 39' ' ' ILE . 53.3 t -55.89 -44.81 79.08 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 O-C-N 124.435 1.084 . . . . 72.14 111.279 -179.388 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.476 HD23 HD11 ' A' ' 39' ' ' ILE . 75.6 mt -62.14 -38.83 90.46 Favored 'General case' 0 N--CA 1.481 1.1 0 O-C-N 123.643 0.589 . . . . 63.45 110.666 176.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -71.89 -20.5 78.83 Favored Glycine 0 CA--C 1.531 1.036 0 CA-C-O 119.803 -0.443 . . . . 73.34 113.563 176.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 60.8 mt -85.71 -45.98 11.14 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.044 0.537 . . . . 60.45 111.137 177.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.476 HD11 HD23 ' A' ' 36' ' ' LEU . 14.3 pt -78.34 -43.22 26.96 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 CA-C-O 118.869 -0.586 . . . . 71.44 110.904 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 27.8 ttpp -52.4 -53.65 50.83 Favored Pre-proline 0 N--CA 1.494 1.77 0 N-CA-C 114.37 1.248 . . . . 72.22 114.37 -173.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -62.35 -32.64 81.37 Favored 'Trans proline' 0 C--N 1.385 2.479 0 C-N-CA 121.768 1.645 . . . . 72.01 112.459 -179.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.429 ' O ' ' HB2' ' A' ' 46' ' ' GLN . 4.3 mm? -75.16 -37.01 61.48 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 115.553 -0.749 . . . . 73.53 110.757 177.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.456 ' HG3' HD12 ' A' ' 8' ' ' ILE . 78.6 mt-10 -67.06 -40.5 87.09 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 124.585 1.154 . . . . 75.42 111.25 -177.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 30.0 mmt -60.67 -40.28 91.52 Favored 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.984 0.803 . . . . 75.11 110.542 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.9 mt -80.7 -26.33 37.55 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.615 0.766 . . . . 75.35 111.481 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -74.76 -29.22 61.06 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.106 0.962 . . . . 63.23 109.942 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -59.28 -34.24 72.04 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.306 0.642 . . . . 75.11 110.899 175.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -75.27 -55.57 5.58 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 108.525 -0.917 . . . . 73.22 108.525 169.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 60.74 23.91 61.61 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-N 115.334 -0.848 . . . . 61.13 113.25 -179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -77.88 171.42 15.01 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.89 0.876 . . . . 71.14 110.587 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.0 ptt180 -64.22 146.26 54.61 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-O 121.183 0.516 . . . . 70.51 111.118 -178.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 66.3 m -132.13 -157.59 0.83 Allowed 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 107.92 -1.141 . . . . 53.31 107.92 176.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 45.2 t -106.07 89.94 4.16 Favored Pre-proline 0 CA--C 1.552 1.049 0 N-CA-C 108.168 -1.049 . . . . 72.24 108.168 167.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.626 ' HA ' HD12 ' A' ' 58' ' ' LEU . 14.8 Cg_exo -71.04 162.95 40.94 Favored 'Trans proline' 0 C--N 1.382 2.291 0 C-N-CA 122.828 2.352 . . . . 75.12 112.365 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.516 ' HB3' ' HG ' ' A' ' 58' ' ' LEU . 43.6 t -158.68 160.17 36.14 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.359 0.664 . . . . 72.42 109.806 -173.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -69.41 -27.85 65.64 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.69 -0.687 . . . . 44.14 110.602 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -74.2 -30.54 62.25 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 122.859 0.464 . . . . 71.24 111.028 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.626 HD12 ' HA ' ' A' ' 54' ' ' PRO . 59.1 mt -69.46 -41.77 75.78 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.437 0.461 . . . . 65.34 109.978 176.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 13.4 m -61.14 -49.0 79.04 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 124.181 0.925 . . . . 70.1 109.933 175.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 79.9 m -60.98 -40.43 93.43 Favored 'General case' 0 N--CA 1.477 0.891 0 O-C-N 123.75 0.656 . . . . 74.52 111.24 178.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.411 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -62.29 -50.11 72.97 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.684 0.794 . . . . 74.25 110.854 179.782 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.515 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 22.6 mmt -72.63 -19.38 61.46 Favored 'General case' 0 CA--C 1.549 0.907 0 CA-C-N 115.271 -0.877 . . . . 70.31 112.34 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -78.22 -44.12 26.51 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 122.916 0.486 . . . . 61.43 110.248 174.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 64.8 mtp85 -60.6 -46.18 91.2 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 124.191 0.996 . . . . 74.11 109.914 175.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.9 t80 -65.83 -50.92 62.89 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-N 114.569 -1.196 . . . . 53.02 109.444 -176.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.495 ' O ' ' HG2' ' A' ' 70' ' ' GLU . 7.4 ttpm? -54.45 -46.57 73.31 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.455 0.702 . . . . 71.41 111.065 178.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.99 -43.71 94.99 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 124.038 0.836 . . . . 74.22 111.17 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.519 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.57 -39.2 88.36 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.632 -0.713 . . . . 64.11 111.546 178.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.453 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -65.64 -34.15 77.55 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.22 1.008 . . . . 71.01 111.299 175.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 80.9 mm-40 -61.06 -49.7 76.29 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.313 0.645 . . . . 64.33 109.283 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 33.7 mt-10 -59.32 -44.19 92.61 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.291 -1.322 . . . . 74.33 111.032 -179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.55 -42.98 99.88 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 123.914 0.759 . . . . 74.55 111.34 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -61.47 -36.42 80.39 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 123.812 0.695 . . . . 72.52 110.101 175.309 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.434 ' O ' ' HG3' ' A' ' 78' ' ' LYS . . . -70.2 -36.72 71.43 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 114.83 -1.077 . . . . 65.44 112.328 177.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 11.5 mm-40 -62.63 -51.43 67.31 Favored 'General case' 0 C--N 1.351 0.651 0 C-N-CA 122.881 0.472 . . . . 52.45 109.774 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.582 HD11 HG12 ' A' ' 14' ' ' ILE . 2.3 pt -74.63 -19.39 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 N-CA-C 112.566 0.58 . . . . 73.0 112.566 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.79 -40.63 93.35 Favored 'General case' 0 N--CA 1.478 0.973 0 N-CA-C 109.606 -0.516 . . . . 71.3 109.606 167.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' A' ' 74' ' ' GLY . 77.1 mttt -74.77 -45.42 43.9 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.498 0.719 . . . . 65.11 110.616 175.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.56 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 20.5 m-30 -73.32 -4.28 32.32 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 124.116 0.966 . . . . 65.14 112.542 -173.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.9 p -57.33 -32.12 66.39 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.083 0.553 . . . . 72.54 110.234 171.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 23.6 m120 -84.43 118.8 24.49 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 115.149 -0.932 . . . . 72.44 109.265 167.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.569 ' HG2' ' HB2' ' A' ' 22' ' ' LYS . 4.1 mpt_? -74.14 -31.72 62.86 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.429 1.092 . . . . 74.45 110.046 -176.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.7 m -64.93 -36.05 83.14 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 114.813 -1.085 . . . . 74.31 111.04 174.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -63.4 -40.7 97.92 Favored 'General case' 0 C--O 1.252 1.185 0 C-N-CA 123.436 0.695 . . . . 74.42 110.532 178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.537 HG23 HD11 ' A' ' 97' ' ' LEU . 21.8 mt -58.91 -55.48 23.08 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 O-C-N 124.133 0.895 . . . . 75.21 109.536 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 50.7 t -56.22 -40.03 73.41 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.862 0.726 . . . . 65.14 111.911 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -61.8 -46.09 91.04 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.92 0.888 . . . . 55.13 111.452 -177.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -84.28 -22.96 30.54 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-O 119.552 -0.261 . . . . 73.22 110.648 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.4 tp -73.3 -36.57 66.3 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.85 0.86 . . . . 75.31 110.662 -174.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.0 t -74.65 -14.49 60.76 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 115.119 -0.946 . . . . 64.22 110.28 175.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -108.82 11.15 26.4 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.541 1.136 . . . . 73.42 110.163 174.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.7 t -114.12 127.05 55.74 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 124.035 0.934 . . . . 32.43 108.932 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -88.97 -20.48 24.4 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.851 0.861 . . . . 74.1 109.968 -178.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -92.93 164.84 13.16 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.921 0.888 . . . . 72.02 111.323 -172.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -85.42 -47.35 10.05 Favored 'General case' 0 C--O 1.24 0.562 0 C-N-CA 124.672 1.189 . . . . 62.44 111.032 -174.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.427 ' H ' HD12 ' A' ' 96' ' ' ILE . 2.7 mp -81.11 117.24 26.79 Favored 'Isoleucine or valine' 0 C--N 1.351 0.645 0 N-CA-C 109.133 -0.692 . . . . 74.51 109.133 -169.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.537 HD11 HG23 ' A' ' 85' ' ' ILE . 12.0 tp -60.68 -30.87 70.19 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.968 1.307 . . . . 72.01 111.875 -175.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 30.5 m-85 -111.65 13.06 21.21 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 117.679 -1.153 . . . . 74.11 111.423 -175.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -37.15 -57.86 0.84 Allowed 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 114.512 1.301 . . . . 73.23 114.512 -159.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.476 ' O ' ' HG3' ' A' ' 104' ' ' LYS . 16.3 t70 -54.84 -62.44 1.66 Allowed 'General case' 0 N--CA 1.479 0.983 0 O-C-N 124.432 1.083 . . . . 74.43 110.749 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 82.0 t -60.03 -49.04 85.56 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.526 0 CA-C-N 114.903 -1.044 . . . . 73.55 111.676 -174.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.7 -28.62 67.01 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.344 0.658 . . . . 65.53 111.331 -175.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -69.65 -34.17 73.64 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.366 -0.605 . . . . 74.13 109.366 172.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.476 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 57.1 mtpt -66.74 -42.64 85.91 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 119.148 -0.453 . . . . 71.31 110.873 174.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.519 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -59.83 -40.11 87.39 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 109.762 -0.458 . . . . 75.54 109.762 171.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.656 ' HB2' HH12 ' A' ' 34' ' ' ARG . 21.6 t -66.86 -42.53 85.52 Favored 'General case' 0 N--CA 1.47 0.574 0 O-C-N 123.765 0.666 . . . . 61.33 111.758 -177.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -70.14 -47.63 60.88 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.659 0.783 . . . . 73.4 109.856 -177.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 45.6 t -72.88 -21.7 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.171 -0.922 . . . . 75.24 110.873 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.417 ' HA ' ' HB2' ' A' ' 112' ' ' LEU . 42.5 t-105 -78.54 -35.24 46.44 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 118.469 0.577 . . . . 74.24 110.855 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 25.1 mtpp -57.71 -52.52 65.1 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.616 -0.883 . . . . 70.41 108.616 172.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.488 ' O ' ' HG ' ' A' ' 115' ' ' LEU . 49.7 mt-10 -57.69 -49.3 76.95 Favored 'General case' 0 C--N 1.351 0.631 0 CA-C-N 114.359 -1.291 . . . . 65.2 110.261 175.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.436 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 0.5 OUTLIER -54.75 -60.5 3.28 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 124.512 1.132 . . . . 75.51 109.444 -174.503 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 84.4 p -59.18 -37.19 76.76 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.269 -0.878 . . . . 64.42 111.501 -175.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 71.0 mt -65.5 -57.29 8.6 Favored 'General case' 0 N--CA 1.479 1.019 0 N-CA-C 111.922 0.341 . . . . 72.35 111.922 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 111' ' ' GLU . 3.6 pp -66.28 -35.28 79.99 Favored 'General case' 0 N--CA 1.488 1.453 0 CA-C-N 117.982 0.355 . . . . 72.52 111.6 -175.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.546 HD22 ' SD ' ' A' ' 122' ' ' MET . 94.1 mt -67.82 -50.94 53.96 Favored 'General case' 0 C--O 1.213 -0.823 0 C-N-CA 123.183 0.593 . . . . 74.4 110.57 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -69.16 -45.71 69.36 Favored 'General case' 0 N--CA 1.485 1.276 0 CA-C-O 121.118 0.485 . . . . 51.33 112.062 -173.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 94.0 t -84.76 -42.41 16.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.658 0 CA-C-N 115.378 -0.828 . . . . 75.0 111.39 -171.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -95.5 -57.75 2.31 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 109.47 -0.567 . . . . 41.31 109.47 -175.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.4 -11.85 59.89 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 123.521 0.729 . . . . 72.32 111.308 -174.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 27.1 mmt85 65.57 44.15 3.11 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 125.259 1.424 . . . . 60.52 112.017 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.546 ' SD ' HD22 ' A' ' 116' ' ' LEU . 42.5 mtp -110.5 112.63 56.56 Favored Pre-proline 0 N--CA 1.479 1.014 0 C-N-CA 124.49 1.116 . . . . 64.3 109.8 -179.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -77.12 67.53 7.59 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.887 2.391 . . . . 71.32 112.061 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 24.0 m -109.36 94.24 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.009 0 C-N-CA 124.41 1.084 . . . . 64.2 110.304 -174.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 26.3 t -164.24 68.04 1.49 Allowed Pre-proline 0 CA--C 1.553 1.068 0 CA-C-N 115.629 -0.714 . . . . 73.1 109.21 174.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -90.25 4.67 4.61 Favored 'Trans proline' 0 C--N 1.377 2.066 0 C-N-CA 123.088 2.525 . . . . 75.43 114.002 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.495 HD12 ' CZ2' ' A' ' 133' ' ' TRP . 5.5 pt -139.74 84.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.304 0.641 . . . . 73.11 110.625 -170.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . 0.434 ' HB3' ' HB2' ' A' ' 133' ' ' TRP . 37.6 t 62.34 178.42 0.13 Allowed 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.386 1.074 . . . . 52.04 111.538 177.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.71 -30.21 45.84 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 107.992 -1.114 . . . . 54.31 107.992 170.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 122.0 -17.54 8.63 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 115.684 -0.689 . . . . 63.44 112.434 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -69.81 -57.55 4.95 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.25 0.62 . . . . 63.31 110.673 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 45.9 t -70.9 -27.83 64.08 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.214 0.606 . . . . 73.35 110.52 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.513 ' HZ3' ' HA ' ' A' ' 106' ' ' SER . 5.8 t90 -60.1 -25.3 65.32 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 123.899 0.879 . . . . 73.42 111.344 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -83.22 -39.84 20.41 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.736 0.814 . . . . 63.55 111.491 173.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -67.74 -34.31 76.58 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 123.857 0.863 . . . . 62.33 111.518 -173.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -57.72 -35.08 70.19 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 114.47 -1.241 . . . . 74.51 111.024 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -65.66 -43.45 89.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.157 0.583 . . . . 73.5 111.557 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.47 -59.81 4.3 Favored 'General case' 0 N--CA 1.475 0.795 0 O-C-N 123.941 0.776 . . . . 74.14 110.259 176.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.41 -54.18 48.64 Favored 'General case' 0 N--CA 1.477 0.914 0 O-C-N 124.197 0.936 . . . . 64.53 111.846 -175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.41 -49.86 75.18 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.195 0.934 . . . . 73.33 110.857 -173.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.448 ' HB2' ' NH2' ' A' ' 30' ' ' ARG . . . -66.71 -31.28 71.84 Favored 'General case' 0 C--O 1.222 -0.354 0 O-C-N 124.159 0.912 . . . . 71.15 111.432 -178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -62.27 -52.66 62.81 Favored 'General case' 0 C--N 1.355 0.806 0 O-C-N 123.636 0.585 . . . . 73.4 110.12 175.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -60.27 -36.08 77.0 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 124.263 0.977 . . . . 71.4 111.458 179.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 27.9 t70 -75.73 -50.21 15.98 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.371 1.068 . . . . 72.12 112.045 -172.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -66.03 -33.34 75.59 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 109.148 -0.686 . . . . 75.22 109.148 175.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -67.35 -32.23 73.03 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 123.048 0.539 . . . . 62.22 109.988 174.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -73.59 -21.86 60.2 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.244 0.618 . . . . 64.32 111.335 174.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -69.37 -54.91 12.12 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 109.394 -0.595 . . . . 74.22 109.394 169.303 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -61.56 -47.52 85.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.386 0.674 . . . . 70.31 111.565 -177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 40.6 ttm -84.76 -72.74 0.46 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.599 0.76 . . . . 43.34 109.441 -173.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 35.5 tp 64.68 151.51 0.04 OUTLIER 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 125.347 1.459 . . . . 53.02 112.331 -178.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -147.68 71.54 1.2 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.42 0.688 . . . . 75.52 109.687 171.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -164.2 -69.14 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.524 -0.762 . . . . 72.23 110.443 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -86.64 -77.44 0.32 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 109.287 -0.635 . . . . 63.33 109.287 -178.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 17.4 m120 65.37 -171.21 0.19 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.588 1.155 . . . . 73.11 112.458 173.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 . . . . . 0 C--O 1.249 1.056 0 C-N-CA 124.518 1.127 . . . . 62.1 109.255 177.635 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 ttm . . . . . 0 N--CA 1.485 1.305 0 N-CA-C 111.487 0.181 . . . . 71.23 111.487 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.89 -34.37 73.08 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 122.903 0.481 . . . . 72.34 110.605 -179.147 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.636 ' HB3' ' HB3' ' A' ' 62' ' ' MET . 16.4 m120 -59.15 -59.7 5.04 Favored 'General case' 0 N--CA 1.474 0.745 0 O-C-N 123.891 0.745 . . . . 65.11 109.934 177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.486 ' O ' HG12 ' A' ' 8' ' ' ILE . 56.8 mt -61.91 -39.53 92.33 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 124.29 0.994 . . . . 72.22 112.165 -178.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -58.28 -48.06 81.66 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.431 0.692 . . . . 60.41 109.91 179.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -72.38 -41.57 66.2 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-O 118.766 -0.635 . . . . 55.43 111.528 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 61.6 mt -52.56 -49.26 45.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 C-N-CA 123.648 0.779 . . . . 74.42 110.673 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.486 HG12 ' O ' ' A' ' 4' ' ' LEU . 28.6 mm -71.69 -41.53 71.03 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-N 114.685 -1.143 . . . . 63.53 111.202 -177.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 97.2 m -61.51 -59.12 5.72 Favored 'General case' 0 C--N 1.357 0.893 0 C-N-CA 122.893 0.477 . . . . 73.33 110.053 179.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.411 ' O ' HG13 ' A' ' 14' ' ' ILE . 27.2 mt -52.06 -49.4 63.55 Favored 'General case' 0 C--O 1.216 -0.664 0 C-N-CA 124.309 1.044 . . . . 64.04 111.517 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.49 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -64.08 -39.05 96.83 Favored Glycine 0 C--N 1.351 1.383 0 O-C-N 123.955 0.785 . . . . 44.41 114.081 -177.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 tp-100 -69.47 -44.26 71.55 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 109.284 -0.636 . . . . 72.52 109.284 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.467 HG12 ' HD2' ' A' ' 17' ' ' ARG . 69.5 t -61.88 -31.35 50.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.2 1.0 . . . . 74.21 111.013 175.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.507 HG21 HG21 ' A' ' 35' ' ' VAL . 68.3 mt -61.03 -53.26 51.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 N-CA-C 109.047 -0.723 . . . . 70.34 109.047 172.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.1 t60 -58.33 -30.61 66.84 Favored 'General case' 0 CA--C 1.552 1.047 0 O-C-N 123.884 0.74 . . . . 72.4 112.142 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -76.45 -51.44 11.78 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 122.893 0.477 . . . . 73.32 111.672 177.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.467 ' HD2' HG12 ' A' ' 13' ' ' VAL . 9.7 ptm180 -84.47 -19.53 33.21 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.977 0.511 . . . . 74.14 112.235 -169.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.521 ' SG ' HD23 ' A' ' 31' ' ' LEU . 21.8 t -71.17 -19.84 62.36 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.499 0.72 . . . . 74.04 110.413 177.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -63.88 -13.17 42.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.284 0.634 . . . . 74.52 111.675 173.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.93 -28.54 70.14 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.491 0.717 . . . . 65.22 110.247 174.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 13.6 mmt -70.31 89.24 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.126 0.571 . . . . 74.01 110.138 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -77.81 -24.01 48.9 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.299 -1.0 . . . . 64.12 108.299 170.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.536 ' HD1' ' HG2' ' A' ' 82' ' ' ARG . 83.8 m-85 -104.23 171.79 7.15 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.624 1.17 . . . . 74.33 109.461 167.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.649 ' SG ' HG21 ' A' ' 85' ' ' ILE . 57.9 m 53.01 49.92 19.1 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 124.093 0.87 . . . . 61.5 110.936 -175.508 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 29' ' ' ARG . 51.1 pttt -61.5 -49.68 75.78 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 113.726 -1.579 . . . . 72.12 111.904 -174.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.574 ' HB3' ' HB2' ' A' ' 140' ' ' ASP . 28.6 mmtp -67.31 -45.26 77.05 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.544 0.337 . . . . 71.03 111.648 -174.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.82 -33.14 75.16 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.114 0.565 . . . . 74.4 110.999 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.508 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 21.5 t -75.72 -38.51 58.5 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.938 0.895 . . . . 72.41 111.849 179.033 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 25' ' ' LYS . 50.9 mtp85 -66.86 -41.8 86.75 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.798 -0.445 . . . . 73.14 109.798 178.705 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.43 ' HD3' ' HB3' ' A' ' 136' ' ' GLU . 32.3 ttp85 -63.04 -47.83 81.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.32 -0.854 . . . . 72.31 110.84 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.521 HD23 ' SG ' ' A' ' 18' ' ' CYS . 61.2 tp -55.08 -57.73 10.52 Favored 'General case' 0 N--CA 1.481 1.076 0 O-C-N 123.677 0.61 . . . . 70.22 110.776 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.91 -42.95 98.46 Favored Glycine 0 C--N 1.351 1.362 0 O-C-N 124.061 0.85 . . . . 71.33 113.571 -177.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -60.02 -46.39 89.67 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.314 0.646 . . . . 65.25 111.514 179.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.515 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 70.2 mtt-85 -61.55 -53.83 51.16 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 123.837 0.71 . . . . 75.42 110.333 178.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.507 HG21 HG21 ' A' ' 14' ' ' ILE . 77.1 t -53.62 -43.54 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 O-C-N 124.168 0.918 . . . . 71.45 111.415 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 39' ' ' ILE . 72.5 mt -63.4 -46.16 87.69 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 123.695 0.622 . . . . 63.41 111.147 177.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.94 -22.81 65.05 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.084 -0.507 . . . . 52.32 113.31 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.573 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 36.6 mt -87.0 -42.55 13.02 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.452 0.701 . . . . 64.2 112.546 178.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.549 HD11 HD23 ' A' ' 36' ' ' LEU . 18.7 pt -80.94 -40.14 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 112.096 0.406 . . . . 73.44 112.096 -172.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -57.55 -44.04 99.29 Favored Pre-proline 0 N--CA 1.486 1.374 0 N-CA-C 114.257 1.206 . . . . 70.35 114.257 -173.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.432 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 13.5 Cg_endo -55.94 -31.84 83.32 Favored 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 122.325 2.016 . . . . 60.11 112.609 174.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.447 HD13 HD21 ' A' ' 45' ' ' LEU . 3.3 mm? -83.25 -29.87 28.1 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 116.044 -0.526 . . . . 73.44 110.383 177.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.54 -31.84 72.81 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.985 0.514 . . . . 62.43 110.837 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.5 mtm -65.89 -45.84 80.55 Favored 'General case' 0 CA--C 1.546 0.789 0 O-C-N 123.423 0.452 . . . . 63.04 111.556 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 HD13 ' A' ' 42' ' ' LEU . 4.3 pp -76.35 -26.97 56.27 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.277 0.231 . . . . 73.12 111.167 179.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -64.3 -42.49 96.35 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.121 0.969 . . . . 72.13 109.704 175.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -62.48 -37.55 86.39 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 114.475 -1.239 . . . . 45.43 110.599 175.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -71.24 -30.01 65.8 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 116.005 -0.543 . . . . 54.44 111.071 175.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 61.17 31.83 78.32 Favored Glycine 0 C--N 1.356 1.654 0 O-C-N 123.684 0.615 . . . . 40.05 113.822 177.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -74.33 143.46 44.92 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 112.241 0.46 . . . . 72.02 112.241 -172.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.7 mtp180 -64.92 89.13 0.07 Allowed 'General case' 0 C--N 1.356 0.862 0 C-N-CA 124.266 1.027 . . . . 65.31 110.476 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.2 p -81.38 153.52 26.93 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 115.545 -0.752 . . . . 72.52 109.319 171.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.46 100.71 14.58 Favored Pre-proline 0 C--O 1.242 0.662 0 N-CA-C 108.903 -0.777 . . . . 72.34 108.903 175.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -75.07 85.5 1.53 Allowed 'Trans proline' 0 C--N 1.369 1.624 0 C-N-CA 122.399 2.066 . . . . 70.42 110.431 173.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 30.3 t -68.09 179.22 1.58 Allowed 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.156 -1.383 . . . . 64.44 110.0 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mt-10 -54.22 -56.9 13.76 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.389 0.676 . . . . 72.32 110.147 178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.454 ' HE3' ' HG3' ' A' ' 119' ' ' GLU . 47.0 pttt -68.77 -31.24 70.13 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 115.278 -0.874 . . . . 64.34 112.639 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.442 HD22 HD13 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -65.88 -55.74 15.44 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 108.702 -0.851 . . . . 71.23 108.702 -178.124 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.4 m -67.5 -36.05 80.33 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.2 -0.909 . . . . 74.43 111.372 -178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 100.0 m -62.31 -45.99 90.74 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 123.266 0.354 . . . . 62.44 110.962 177.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -60.03 -44.78 94.4 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 123.571 0.544 . . . . 63.01 110.459 176.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.636 ' HB3' ' HB3' ' A' ' 3' ' ' ASN . 24.8 mmt -68.38 -25.97 65.33 Favored 'General case' 0 CA--C 1.557 1.215 0 CA-C-N 115.588 -0.733 . . . . 63.22 112.252 178.273 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 69.0 m-20 -75.7 -45.65 35.63 Favored 'General case' 0 N--CA 1.495 1.795 0 C-N-CA 123.788 0.835 . . . . 73.42 110.269 177.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 60.2 mtp85 -62.88 -42.42 99.76 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.261 1.025 . . . . 61.21 110.245 179.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.573 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 6.3 t80 -67.03 -52.57 40.79 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 114.903 -1.044 . . . . 74.14 109.297 -178.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -51.61 -47.12 63.75 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.41 1.084 . . . . 73.43 110.635 177.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.3 90.77 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 123.982 0.801 . . . . 42.04 111.486 178.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -65.19 -38.37 90.27 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.832 0.853 . . . . 65.11 111.512 179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 65' ' ' PHE . 4.5 mm? -63.37 -35.16 79.47 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.829 0.852 . . . . 71.12 111.046 174.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -68.69 -38.78 80.59 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.86 0.464 . . . . 74.22 111.171 175.043 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 24.7 mm-40 -59.24 -49.32 78.29 Favored 'General case' 0 N--CA 1.481 1.09 0 O-C-N 123.478 0.486 . . . . 74.14 109.954 176.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.449 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -59.74 -52.16 66.66 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 124.222 0.951 . . . . 41.42 111.634 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -56.44 -45.61 80.7 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.582 1.153 . . . . 73.12 111.758 -179.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.38 -38.83 91.49 Favored Glycine 0 C--N 1.344 0.988 0 CA-C-N 114.81 -1.086 . . . . 52.31 112.874 -176.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -76.84 -37.26 55.97 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.221 -0.895 . . . . 62.12 112.183 -175.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.518 HG23 ' CZ ' ' A' ' 98' ' ' PHE . 0.5 OUTLIER -65.38 -32.53 58.62 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.492 1.042 . . . . 64.44 110.505 171.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -58.66 -47.5 84.24 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.323 -0.621 . . . . 63.4 109.323 171.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -71.6 -27.94 63.47 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.085 0.554 . . . . 44.11 112.248 -179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -85.77 4.51 36.58 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.743 0.817 . . . . 74.32 111.886 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 78.7 p -58.96 -26.44 64.43 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-O 121.019 0.438 . . . . 51.43 111.201 175.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -79.23 108.15 12.52 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.274 -1.01 . . . . 75.44 108.274 165.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.536 ' HG2' ' HD1' ' A' ' 23' ' ' TYR . 2.3 mpt_? -71.34 -24.08 62.04 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.28 0.632 . . . . 75.03 109.924 179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.9 m -67.43 -35.74 79.85 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.724 0.81 . . . . 60.04 111.246 172.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -62.85 -41.0 99.18 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.051 0.94 . . . . 73.14 110.067 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.649 HG21 ' SG ' ' A' ' 24' ' ' CYS . 46.8 mt -59.73 -59.08 4.49 Favored 'Isoleucine or valine' 0 C--N 1.352 0.715 0 CA-C-N 114.754 -1.112 . . . . 75.23 109.671 175.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 45.6 t -56.46 -33.48 65.95 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.176 0.59 . . . . 74.41 111.999 -178.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.6 tpt180 -60.04 -53.66 55.23 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.36 1.064 . . . . 70.14 111.258 177.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -77.96 -26.79 48.99 Favored 'General case' 0 N--CA 1.482 1.167 0 O-C-N 122.306 -0.246 . . . . 70.34 110.458 179.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.537 ' HG ' ' HG2' ' A' ' 145' ' ' ARG . 10.5 tp -72.7 -36.51 67.86 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.811 0.844 . . . . 75.33 110.951 -169.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.7 t -67.53 -30.67 70.38 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 115.664 -0.698 . . . . 74.54 110.605 175.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.25 -3.48 57.78 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.142 0.977 . . . . 51.12 110.936 177.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.3 t -94.39 126.68 39.81 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.095 0.958 . . . . 63.44 110.485 177.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -90.92 -44.45 9.35 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.748 0.819 . . . . 74.22 109.391 171.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -147.62 7.99 0.87 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.297 1.039 . . . . 73.23 111.333 -175.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -75.24 84.21 2.41 Favored 'General case' 0 C--N 1.348 0.517 0 N-CA-C 108.208 -1.034 . . . . 65.42 108.208 174.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.566 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 22.2 mm -63.72 146.26 13.11 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 114.696 -1.138 . . . . 73.42 108.464 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -36.99 -54.17 0.95 Allowed 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 125.714 1.606 . . . . 61.1 112.232 -178.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.518 ' CZ ' HG23 ' A' ' 76' ' ' ILE . 52.9 m-85 -128.49 42.37 3.33 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 114.97 -1.014 . . . . 74.25 112.006 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.566 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 4.9 tmtm? -58.58 -61.1 2.85 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-N 119.512 1.051 . . . . 71.24 109.916 -177.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -65.83 -41.03 92.29 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.287 -0.869 . . . . 54.34 111.626 -174.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 32.7 t -67.86 -43.63 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 O-C-N 123.513 0.508 . . . . 72.3 110.851 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.427 HD21 ' CZ ' ' A' ' 34' ' ' ARG . 19.4 t30 -61.41 -38.88 88.72 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-N 115.563 -0.744 . . . . 74.51 110.269 174.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.83 -31.89 72.8 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.033 0.533 . . . . 72.44 109.801 177.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.81 -56.68 10.63 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.154 0.582 . . . . 74.42 109.878 174.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 7.8 mp -55.3 -38.87 69.22 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.688 0.618 . . . . 40.3 111.008 178.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.2 t -73.66 -49.07 27.75 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.527 0.731 . . . . 73.52 111.888 -174.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -64.41 -48.59 74.83 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.44 0.696 . . . . 74.02 109.674 -177.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.1 t -64.52 -37.12 79.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 CA-C-N 114.968 -1.015 . . . . 74.52 110.516 177.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.42 ' HZ3' HD21 ' A' ' 42' ' ' LEU . 61.2 t-105 -60.97 -38.65 86.71 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.56 0.344 . . . . 75.44 111.497 176.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -59.0 -56.9 16.3 Favored 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.118 -0.697 . . . . 74.4 109.118 175.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -55.27 -44.69 75.84 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.199 0.937 . . . . 70.32 111.16 179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.427 HD11 ' SD ' ' A' ' 62' ' ' MET . 8.4 tt -69.82 -53.4 18.38 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.29 1.436 . . . . 74.43 110.796 -171.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.5 t -63.64 -36.02 82.44 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.371 0.668 . . . . 65.4 110.998 -179.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 87.5 mt -61.54 -53.54 54.96 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.563 0.539 . . . . 70.4 111.155 176.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.442 HD13 HD22 ' A' ' 58' ' ' LEU . 3.9 pp -70.05 -24.42 63.25 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.089 -0.382 . . . . 71.12 111.796 -177.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 67.3 mt -70.17 -43.14 71.45 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 122.297 0.239 . . . . 62.24 111.149 173.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -80.54 -23.06 40.24 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 112.509 0.559 . . . . 70.03 112.509 -174.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 57.7 t -90.96 -50.13 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 122.407 0.283 . . . . 53.32 111.203 178.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.454 ' HG3' ' HE3' ' A' ' 57' ' ' LYS . 24.8 mm-40 -81.34 -56.76 3.84 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.924 0.392 . . . . 74.21 110.883 -176.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -86.72 -1.36 57.66 Favored 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 115.647 -0.706 . . . . 74.12 110.83 -175.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 11.7 mmt180 65.52 19.01 11.46 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 125.173 1.389 . . . . 73.14 113.331 170.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . . . . . . . . . 50.9 mtp -70.64 143.05 89.37 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.708 0.803 . . . . 71.53 112.01 -173.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -83.15 24.98 0.71 Allowed 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.464 2.109 . . . . 74.52 113.194 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 16.9 m -75.17 115.83 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-O 121.46 0.648 . . . . 61.44 111.932 -177.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 24.3 t -166.95 65.49 0.82 Allowed Pre-proline 0 CA--C 1.552 1.048 0 CA-C-N 114.491 -1.232 . . . . 64.03 108.265 171.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.432 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 42.9 Cg_endo -87.39 28.88 0.5 Allowed 'Trans proline' 0 C--N 1.381 2.256 0 C-N-CA 123.526 2.818 . . . . 62.12 111.911 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 6.7 tt -146.55 152.43 13.52 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 C-N-CA 125.024 1.33 . . . . 75.44 108.101 -176.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 49.4 m -83.31 -158.69 0.3 Allowed 'General case' 0 CA--C 1.556 1.197 0 C-N-CA 122.95 0.5 . . . . 42.12 110.052 172.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -62.8 -37.96 88.81 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.673 0.789 . . . . 73.03 111.62 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 122.13 1.91 10.25 Favored Glycine 0 N--CA 1.472 1.052 0 CA-C-O 119.538 -0.59 . . . . 75.21 113.533 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.62 -43.13 97.83 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.481 0.712 . . . . 51.2 111.603 -179.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . 0.467 ' O ' ' HG3' ' A' ' 136' ' ' GLU . 31.6 m -66.76 -39.79 88.02 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.725 -0.67 . . . . 75.34 110.179 175.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.433 ' HH2' HD21 ' A' ' 38' ' ' LEU . 5.8 m0 -62.79 -18.03 62.08 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.307 0.854 . . . . 73.23 113.307 -178.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -82.91 -41.35 19.01 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-O 121.149 0.5 . . . . 45.52 110.69 169.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -80.78 -23.76 39.08 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 113.134 0.79 . . . . 61.14 113.134 -171.217 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.467 ' HG3' ' O ' ' A' ' 132' ' ' SER . 76.8 mt-10 -62.29 -53.69 51.47 Favored 'General case' 0 N--CA 1.48 1.049 0 O-C-N 123.477 0.486 . . . . 73.5 109.732 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -48.97 -61.82 1.86 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.95 1.406 . . . . 75.32 111.563 -178.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -60.54 -41.04 93.69 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 123.529 0.518 . . . . 54.13 112.304 -179.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.403 ' O ' ' HG3' ' A' ' 143' ' ' GLU . 34.1 tt0 -67.87 -63.29 1.09 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 118.035 0.379 . . . . 61.32 111.746 -175.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 2.6 p30 -73.4 -30.58 63.36 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.276 -0.392 . . . . 72.21 111.623 -171.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.55 -23.06 50.18 Favored 'General case' 0 C--N 1.356 0.86 0 CA-C-O 119.117 -0.468 . . . . 55.4 111.453 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -60.51 -51.95 67.27 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 108.588 -0.893 . . . . 64.0 108.588 164.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 139' ' ' GLN . 36.9 mt-10 -59.44 -40.47 86.9 Favored 'General case' 0 N--CA 1.478 0.938 0 O-C-N 124.085 0.865 . . . . 53.04 111.528 -179.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.478 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 14.2 t0 -79.75 -45.97 17.87 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.16 0.984 . . . . 72.01 110.962 -168.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.537 ' HG2' ' HG ' ' A' ' 89' ' ' LEU . 4.3 tmt_? -62.73 -42.98 99.93 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.191 0.997 . . . . 55.51 109.158 175.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -67.45 -34.24 76.79 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 115.626 -0.716 . . . . 74.51 111.027 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -76.25 -24.9 54.55 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.525 0.33 . . . . 53.22 111.847 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.06 -36.75 35.17 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.845 0.458 . . . . 64.25 110.043 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 34.6 mm-40 -80.51 -41.18 24.7 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.092 0.557 . . . . 73.22 112.042 -179.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 3.4 tpt -102.54 55.97 0.78 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 107.076 -1.453 . . . . 65.13 107.076 176.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.422 HD21 ' HE2' ' A' ' 23' ' ' TYR . 42.3 tp -82.8 87.38 6.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 114.052 -1.431 . . . . 71.51 111.156 -168.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -123.33 66.45 1.0 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.261 -1.014 . . . . 72.21 108.261 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.2 tpp85 -167.4 -49.44 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 114.344 -1.298 . . . . 63.11 109.79 -175.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -132.05 34.17 3.84 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.575 -0.739 . . . . 73.33 110.453 -169.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -69.58 98.38 1.14 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 122.859 0.464 . . . . 74.25 109.888 -179.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 . . . . . 0 C--O 1.249 1.078 0 C-N-CA 125.432 1.493 . . . . 52.31 111.235 -176.071 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.397 0 N-CA-C 112.227 0.454 . . . . 75.21 112.227 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -71.91 -26.38 62.29 Favored 'General case' 0 C--N 1.36 1.032 0 CA-C-N 118.222 0.464 . . . . 74.34 110.238 173.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -59.09 -51.51 69.73 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 109.789 -0.449 . . . . 73.03 109.789 172.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.61 -36.7 81.49 Favored 'General case' 0 N--CA 1.477 0.88 0 O-C-N 124.063 0.852 . . . . 65.52 111.375 175.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -57.53 -47.63 81.48 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 123.532 0.52 . . . . 71.34 109.784 176.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -63.98 -47.99 78.21 Favored 'General case' 0 C--O 1.212 -0.915 0 O-C-N 123.886 0.741 . . . . 74.31 110.977 179.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 95.6 mt -55.13 -49.37 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 C-N-CA 123.999 0.92 . . . . 73.33 111.313 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 35.3 mm -71.31 -43.81 73.43 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 CA-C-N 115.141 -0.936 . . . . 70.32 111.049 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.9 m -62.49 -51.19 68.43 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 122.874 0.469 . . . . 70.14 109.987 179.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 79.1 mt -54.33 -46.48 72.89 Favored 'General case' 0 C--O 1.208 -1.116 0 O-C-N 124.453 1.095 . . . . 75.33 110.548 177.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.44 -52.95 49.77 Favored Glycine 0 CA--C 1.535 1.323 0 O-C-N 124.332 1.02 . . . . 64.23 113.828 -177.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.41 ' HG3' HD12 ' A' ' 39' ' ' ILE . 27.3 mt-30 -66.25 -40.72 90.4 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 122.842 0.457 . . . . 65.22 111.2 -179.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.4 t -61.44 -37.75 78.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.885 0.874 . . . . 73.11 110.427 174.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.516 HD11 ' O ' ' A' ' 69' ' ' LEU . 17.0 mt -59.24 -50.8 78.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 124.663 1.185 . . . . 71.53 109.804 177.743 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.0 t60 -56.97 -43.86 82.04 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 124.354 1.034 . . . . 75.2 111.286 178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.69 -49.41 71.01 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.033 0.533 . . . . 73.04 112.141 179.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.536 ' NH2' ' HA ' ' A' ' 77' ' ' GLU . 10.4 ptm180 -81.8 -16.44 50.92 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 112.495 0.554 . . . . 64.11 112.495 -174.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 28' ' ' CYS . 38.5 t -69.03 -19.84 64.12 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.515 0.726 . . . . 75.15 110.775 173.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -72.13 1.93 6.66 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.48 0.712 . . . . 74.34 112.154 175.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -65.95 -32.1 73.39 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.246 0.618 . . . . 61.52 111.064 165.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.46 ' SD ' ' O ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER -71.4 86.04 0.83 Allowed 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 122.824 0.449 . . . . 63.52 110.897 -176.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -71.31 -47.4 56.93 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 106.7 -1.593 . . . . 72.33 106.7 170.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.438 ' HB3' ' CE2' ' A' ' 148' ' ' PHE . 86.8 m-85 -91.53 142.98 27.06 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 107.358 -1.349 . . . . 71.41 107.358 164.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.531 ' SG ' HG21 ' A' ' 85' ' ' ILE . 38.9 m 63.34 46.05 4.63 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 124.248 0.967 . . . . 75.01 110.247 -160.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 28' ' ' CYS . 56.9 pttt -70.07 -44.29 69.42 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 113.78 -1.555 . . . . 74.3 111.511 -176.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.721 ' HB2' ' HB2' ' A' ' 144' ' ' ASP . 45.1 mtpt -74.22 -26.87 60.5 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 119.178 -0.439 . . . . 74.23 109.83 -178.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.48 -31.22 71.83 Favored 'General case' 0 N--CA 1.482 1.149 0 O-C-N 123.649 0.593 . . . . 71.44 109.969 171.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.652 ' HA ' ' SG ' ' A' ' 18' ' ' CYS . 9.0 t -67.18 -43.63 81.72 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.638 0.775 . . . . 62.44 111.432 175.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -76.39 -24.84 54.09 Favored 'General case' 0 N--CA 1.491 1.585 0 CA-C-O 119.84 -0.124 . . . . 73.53 111.027 176.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 34' ' ' ARG . 4.1 tpm_? -65.09 -59.08 4.52 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 108.547 -0.909 . . . . 74.34 108.547 176.042 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 ' SG ' ' A' ' 18' ' ' CYS . 58.3 tp -61.5 -47.42 85.72 Favored 'General case' 0 C--N 1.352 0.691 0 O-C-N 124.731 1.27 . . . . 51.21 110.615 178.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.59 -54.74 34.59 Favored Glycine 0 C--N 1.343 0.927 0 O-C-N 124.076 0.86 . . . . 54.12 113.67 -174.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -67.01 -32.51 73.79 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.323 0.649 . . . . 73.25 110.617 179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.454 ' HB2' ' O ' ' A' ' 30' ' ' ARG . 1.7 mtt-85 -56.3 -56.93 14.97 Favored 'General case' 0 N--CA 1.478 0.926 0 O-C-N 123.858 0.724 . . . . 73.32 110.645 173.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 31' ' ' LEU . 65.2 t -60.97 -43.22 95.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.647 0 CA-C-N 114.156 -1.384 . . . . 74.2 110.559 -175.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.9 mt -59.47 -50.42 74.01 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.865 0.466 . . . . 55.23 110.939 177.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -67.34 -18.63 69.71 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 115.379 -0.828 . . . . 73.44 113.557 179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 1.1 tt -84.9 -52.56 5.92 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 123.771 0.828 . . . . 74.15 110.259 177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.41 HD12 ' HG3' ' A' ' 12' ' ' GLN . 16.2 pt -75.89 -32.84 24.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 CA-C-O 118.761 -0.638 . . . . 74.2 111.977 -167.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 44' ' ' MET . 92.7 mttt -58.15 -49.56 92.91 Favored Pre-proline 0 CA--C 1.561 1.401 0 CA-C-O 117.609 -1.186 . . . . 72.14 112.506 -178.199 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_exo -45.65 -43.37 18.53 Favored 'Trans proline' 0 C--N 1.401 3.306 0 C-N-CA 122.932 2.421 . . . . 72.4 113.485 169.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -71.05 -38.72 72.53 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.653 0.381 . . . . 52.3 111.19 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 46' ' ' GLN . 47.7 mt-10 -67.42 -20.89 65.58 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 122.794 0.438 . . . . 75.13 111.085 178.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 40' ' ' LYS . 28.3 mmt -68.55 -55.8 10.46 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 110.008 -0.367 . . . . 70.44 110.008 173.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.682 HD23 ' SD ' ' A' ' 122' ' ' MET . 2.6 pp -70.25 -21.49 62.98 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 111.623 0.231 . . . . 64.4 111.623 179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.431 ' HB3' ' HA ' ' A' ' 43' ' ' GLU . 1.3 tm0? -80.44 -33.33 36.89 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.014 0.926 . . . . 44.52 110.35 179.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -70.55 -42.92 70.52 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 109.597 -0.52 . . . . 72.01 109.597 178.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -80.89 2.62 25.81 Favored 'General case' 0 CA--C 1.551 1.002 0 CA-C-N 115.258 -0.883 . . . . 74.13 110.571 170.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -59.31 95.86 0.07 OUTLIER Glycine 0 C--N 1.351 1.377 0 C-N-CA 124.35 0.976 . . . . 62.31 113.312 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.8 ptmt -146.34 141.77 27.59 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 125.141 1.377 . . . . 73.23 107.455 172.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 64.23 96.81 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.547 1.139 . . . . 74.04 109.955 -171.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 9.9 m -72.77 148.92 44.12 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.151 0.58 . . . . 72.23 111.134 -177.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.6 p -147.79 63.36 7.59 Favored Pre-proline 0 CA--C 1.565 1.545 0 C-N-CA 123.569 0.748 . . . . 70.24 109.089 172.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.476 ' HA ' HD23 ' A' ' 58' ' ' LEU . 95.6 Cg_endo -84.51 88.86 0.96 Allowed 'Trans proline' 0 C--N 1.38 2.196 0 C-N-CA 121.74 1.626 . . . . 71.41 110.651 178.751 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.4 p -64.85 163.34 14.47 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 115.175 -0.921 . . . . 60.11 109.833 175.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -52.8 -46.53 67.69 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 123.439 0.696 . . . . 74.01 112.549 -174.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -64.07 -39.49 94.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.737 0.815 . . . . 61.21 111.568 177.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' A' ' 54' ' ' PRO . 41.1 tp -73.97 -35.55 64.51 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.11 0.964 . . . . 74.22 110.423 -175.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 76.3 m -66.54 -49.69 65.63 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.942 0.897 . . . . 54.14 109.077 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.436 ' O ' ' HG3' ' A' ' 64' ' ' ARG . 32.3 m -61.04 -38.31 85.69 Favored 'General case' 0 C--N 1.356 0.862 0 O-C-N 124.06 0.85 . . . . 73.01 110.482 178.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.485 ' HB1' HD12 ' A' ' 112' ' ' LEU . . . -65.4 -45.65 83.15 Favored 'General case' 0 C--N 1.348 0.536 0 C-N-CA 123.565 0.746 . . . . 72.33 110.611 -179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.3 mmt -70.17 -24.96 63.23 Favored 'General case' 0 N--CA 1.483 1.183 0 O-C-N 123.821 0.701 . . . . 73.11 111.666 178.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -71.79 -46.23 58.98 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.218 0.607 . . . . 73.3 110.173 174.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 60' ' ' THR . 99.3 mtt180 -62.44 -38.25 89.02 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.753 0.821 . . . . 73.11 110.311 175.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.482 ' O ' HD23 ' A' ' 69' ' ' LEU . 1.1 t80 -63.32 -59.71 4.35 Favored 'General case' 0 C--N 1.345 0.388 0 CA-C-N 113.704 -1.589 . . . . 74.42 109.192 -176.256 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 25.2 ttpp -56.17 -44.12 79.04 Favored 'General case' 0 C--O 1.217 -0.634 0 O-C-N 124.561 1.163 . . . . 62.34 110.697 178.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -57.55 -42.28 82.65 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 124.258 0.974 . . . . 62.32 112.142 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.551 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -68.86 -39.19 79.99 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.511 0.725 . . . . 52.31 111.418 178.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.516 ' O ' HD11 ' A' ' 14' ' ' ILE . 4.2 mm? -68.53 -31.18 70.24 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.713 0.805 . . . . 73.41 111.131 175.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 55.3 mt-10 -67.44 -43.42 81.19 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 109.646 -0.501 . . . . 61.51 109.646 174.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.72 -38.97 92.81 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.127 -0.942 . . . . 75.25 111.06 178.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.13 -44.96 86.97 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.413 0.685 . . . . 52.03 110.578 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -59.8 -41.6 91.56 Favored 'General case' 0 N--CA 1.476 0.869 0 O-C-N 124.328 1.017 . . . . 63.01 110.658 176.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -66.87 -37.09 91.99 Favored Glycine 0 C--N 1.35 1.307 0 CA-C-N 115.438 -0.801 . . . . 73.1 113.107 177.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -63.58 -52.2 62.04 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 122.832 0.453 . . . . 75.4 110.458 178.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.445 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.0 OUTLIER -70.61 -20.0 22.05 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 N-CA-C 112.616 0.598 . . . . 74.54 112.616 178.982 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.536 ' HA ' ' NH2' ' A' ' 17' ' ' ARG . 3.3 tm-20 -67.32 -43.37 81.8 Favored 'General case' 0 CA--C 1.548 0.874 0 N-CA-C 109.344 -0.613 . . . . 74.35 109.344 170.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -69.38 -40.87 77.17 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.973 0.909 . . . . 73.43 111.416 175.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 13.9 m-85 -80.8 0.34 35.28 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.078 0.951 . . . . 74.41 112.511 -173.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 77.7 p -56.43 -32.29 64.76 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 121.368 0.604 . . . . 71.12 109.859 174.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 20.7 m120 -82.62 112.23 19.31 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 114.858 -1.065 . . . . 70.11 109.441 168.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.9 mpt_? -74.9 -24.35 58.52 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.775 0.83 . . . . 73.03 110.566 -177.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 15.4 m -67.48 -37.55 83.05 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 124.078 0.951 . . . . 63.23 111.076 174.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -59.55 -46.22 89.51 Favored 'General case' 0 C--O 1.255 1.37 0 C-N-CA 124.098 0.959 . . . . 71.0 110.076 173.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.644 HG23 HD11 ' A' ' 97' ' ' LEU . 34.2 mt -58.31 -56.29 17.08 Favored 'Isoleucine or valine' 0 C--N 1.358 0.942 0 CA-C-N 114.573 -1.194 . . . . 61.34 109.956 177.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 42.3 t -53.91 -39.92 66.24 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.675 1.19 . . . . 33.43 111.612 -176.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 40.1 ttm180 -61.04 -54.1 48.94 Favored 'General case' 0 C--N 1.347 0.468 0 O-C-N 124.544 1.153 . . . . 75.05 111.026 179.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -76.67 -22.86 53.42 Favored 'General case' 0 CA--C 1.557 1.218 0 CA-C-N 116.306 -0.407 . . . . 71.42 111.051 -177.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.1 tp -80.75 -33.77 34.82 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.099 0.96 . . . . 65.13 110.888 -172.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 10.7 t -72.75 -20.22 61.23 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 121.125 0.488 . . . . 54.11 109.992 172.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.34 8.9 43.67 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.48 1.112 . . . . 43.34 111.244 174.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.763 ' HB3' ' HB3' ' A' ' 95' ' ' LYS . 67.6 m -151.26 90.53 1.6 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.612 1.165 . . . . 61.4 109.466 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -77.99 -47.33 18.74 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 112.715 0.635 . . . . 74.52 112.715 -165.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -100.09 -22.05 15.35 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 109.711 -0.477 . . . . 72.14 109.711 -179.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.763 ' HB3' ' HB3' ' A' ' 92' ' ' SER . 36.5 ttmt -58.48 117.68 4.76 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 124.678 1.236 . . . . 63.13 111.046 -173.422 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.99 143.22 15.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.657 -1.156 . . . . 75.32 108.217 178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.644 HD11 HG23 ' A' ' 85' ' ' ILE . 4.5 tp -58.13 -30.51 66.38 Favored 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 112.928 0.714 . . . . 72.04 112.928 -168.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -119.63 17.88 12.76 Favored 'General case' 0 C--O 1.211 -0.953 0 CA-C-O 118.159 -0.924 . . . . 70.2 110.645 -176.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.637 ' HG2' ' HG3' ' A' ' 95' ' ' LYS . 0.0 OUTLIER -36.3 -53.32 0.83 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 115.024 1.491 . . . . 73.5 115.024 -160.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.46 ' N ' ' HD3' ' A' ' 99' ' ' LYS . 30.6 m-20 -71.3 -50.75 29.34 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 118.648 0.658 . . . . 73.14 111.564 179.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 86.9 t -58.92 -52.82 55.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 123.944 0.898 . . . . 54.21 111.18 -176.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -63.78 -36.88 85.35 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.334 1.054 . . . . 75.34 110.998 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -62.71 -32.26 73.33 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.197 0.599 . . . . 64.14 110.717 172.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 100' ' ' ASP . 98.9 mttt -70.99 -39.74 72.27 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 119.348 -0.358 . . . . 55.41 110.214 174.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.551 HD12 ' HB1' ' A' ' 68' ' ' ALA . 10.4 mp -58.2 -44.61 88.18 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.603 -0.517 . . . . 73.54 109.603 172.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.4 m -63.11 -50.42 70.57 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.015 0.926 . . . . 60.53 111.347 -179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 111' ' ' GLU . 37.6 t70 -73.56 -44.05 58.35 Favored 'General case' 0 C--N 1.351 0.662 0 CA-C-N 115.128 -0.942 . . . . 74.44 111.184 -171.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.508 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 93.8 t -64.06 -36.48 77.0 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 CA-C-O 118.843 -0.598 . . . . 72.42 109.416 175.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -64.21 -44.71 91.08 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 119.088 -0.482 . . . . 74.14 112.055 178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.447 ' HA ' ' HB2' ' A' ' 129' ' ' GLN . 8.5 ptmm? -64.78 -44.31 90.42 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 118.568 0.622 . . . . 51.12 110.378 177.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 107' ' ' ASP . 11.9 mm-40 -60.8 -41.04 94.86 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.044 0.449 . . . . 61.11 111.076 176.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 1.6 tp -61.57 -59.96 4.42 Favored 'General case' 0 C--O 1.215 -0.726 0 C-N-CA 124.633 1.173 . . . . 72.33 107.941 -177.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.519 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 33.0 t -55.82 -41.22 73.88 Favored 'General case' 0 C--N 1.35 0.601 0 O-C-N 124.557 1.16 . . . . 70.52 111.402 -175.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 81.0 mt -57.7 -54.88 41.87 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 123.886 0.741 . . . . 71.33 111.481 177.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.3 pp -69.21 -23.74 63.93 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 122.497 -0.127 . . . . 63.14 111.185 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.614 HD13 ' SD ' ' A' ' 122' ' ' MET . 95.8 mt -73.86 -28.38 61.55 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.769 0.828 . . . . 74.42 111.038 174.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.519 ' HG2' ' O ' ' A' ' 113' ' ' SER . 27.6 mm-40 -71.94 -43.67 64.86 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.025 0.53 . . . . 74.42 109.639 174.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 40.7 t -74.84 -50.07 26.9 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 116.036 -0.529 . . . . 64.32 112.046 -175.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . 0.417 ' HB2' ' OE1' ' A' ' 120' ' ' GLN . 8.6 mm-40 -82.61 -57.61 3.26 Favored 'General case' 0 N--CA 1.483 1.193 0 N-CA-C 111.936 0.347 . . . . 75.3 111.936 -171.439 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.417 ' OE1' ' HB2' ' A' ' 119' ' ' GLU . 24.5 mp0 -89.14 -29.85 19.04 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 122.519 0.328 . . . . 73.23 111.559 -176.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 38.0 ttm180 56.39 61.84 2.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.465 1.106 . . . . 71.12 110.92 -171.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.682 ' SD ' HD23 ' A' ' 45' ' ' LEU . 22.4 ptm -91.32 147.17 34.88 Favored Pre-proline 0 N--CA 1.476 0.843 0 CA-C-N 114.569 -1.196 . . . . 73.31 108.109 172.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -60.82 -63.2 0.11 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.225 1.95 . . . . 71.15 113.264 -174.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.454 HG23 ' HG3' ' A' ' 122' ' ' MET . 16.2 t 59.24 48.58 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 CA-C-O 122.52 1.152 . . . . 71.04 109.394 -171.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 14.2 m -67.04 -49.99 43.83 Favored Pre-proline 0 CA--C 1.569 1.691 0 CA-C-N 114.747 -1.115 . . . . 64.34 113.966 -179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -75.51 7.76 2.92 Favored 'Trans proline' 0 C--N 1.386 2.536 0 C-N-CA 122.017 1.812 . . . . 70.12 114.771 -167.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.4 HD11 ' CZ2' ' A' ' 133' ' ' TRP . 15.2 tt -155.96 -27.58 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 N-CA-C 112.966 0.728 . . . . 43.14 112.966 -172.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 32.3 t 70.64 -74.28 0.09 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.475 1.11 . . . . 73.52 111.2 -178.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.447 ' HB2' ' HA ' ' A' ' 110' ' ' LYS . 0.8 OUTLIER -162.82 18.92 0.08 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.019 0.928 . . . . 74.51 110.665 176.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 90.33 49.51 3.23 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 115.765 -0.652 . . . . 74.23 112.513 -175.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -71.79 -54.21 10.9 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.26 0.624 . . . . 72.22 110.393 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 12.3 m -62.59 -33.03 74.14 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.052 -0.976 . . . . 74.44 111.561 178.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.4 ' CZ2' HD11 ' A' ' 127' ' ' ILE . 27.4 m0 -52.02 -48.49 64.48 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.966 1.306 . . . . 71.22 113.141 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -54.43 -27.89 40.17 Favored 'General case' 0 CA--C 1.553 1.086 0 N-CA-C 113.056 0.762 . . . . 20.4 113.056 -174.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -88.13 -43.25 11.8 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.121 0.569 . . . . 73.14 110.638 175.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.405 ' HB3' ' NH1' ' A' ' 30' ' ' ARG . 45.3 mt-10 -59.59 -34.69 73.06 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.2 1.0 . . . . 73.3 112.778 -177.076 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.416 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 55.8 m-20 -61.25 -64.39 0.97 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.338 0.655 . . . . 73.21 109.885 -176.169 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -61.45 -43.98 97.91 Favored 'General case' 0 C--O 1.213 -0.824 0 O-C-N 124.059 0.849 . . . . 64.45 110.864 -178.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 25.9 tm0? -64.88 -60.22 3.32 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.399 0.68 . . . . 61.43 110.878 -171.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -67.46 -43.91 79.92 Favored 'General case' 0 C--O 1.247 0.922 0 CA-C-N 114.906 -1.043 . . . . 71.23 111.023 -173.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -67.88 -32.35 72.78 Favored 'General case' 0 C--N 1.358 0.955 0 CA-C-N 116.103 -0.499 . . . . 43.53 111.945 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.473 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 31.2 t70 -65.8 -47.63 74.45 Favored 'General case' 0 N--CA 1.473 0.695 0 O-C-N 123.541 0.526 . . . . 71.14 110.569 176.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -58.51 -41.41 85.34 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 124.108 0.88 . . . . 50.42 111.18 177.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.721 ' HB2' ' HB2' ' A' ' 26' ' ' LYS . 26.4 t0 -64.96 -42.81 94.26 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.762 0.825 . . . . 63.54 111.724 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -62.36 -37.56 86.15 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 115.331 -0.849 . . . . 61.25 109.743 175.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.473 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 97.9 mtt180 -62.63 -43.07 99.75 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.837 0.455 . . . . 74.11 109.926 174.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.61 -22.13 62.57 Favored 'General case' 0 N--CA 1.475 0.796 0 O-C-N 124.018 0.824 . . . . 44.2 111.91 -177.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.438 ' CE2' ' HB3' ' A' ' 23' ' ' TYR . 0.2 OUTLIER -81.72 -55.64 4.51 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 122.981 0.512 . . . . 75.54 110.022 176.086 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 33.9 mm-40 -69.32 -61.38 1.81 Allowed 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.524 -0.762 . . . . 75.23 110.026 -175.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 51.3 ttm -86.06 72.14 10.47 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 107.269 -1.382 . . . . 74.5 107.269 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 51.7 tp -73.74 88.8 1.76 Allowed 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.373 -0.831 . . . . 64.3 109.668 -178.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 -110.01 60.47 0.6 Allowed 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.36 -0.978 . . . . 72.54 108.36 179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -159.83 -47.77 0.05 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 114.539 -1.21 . . . . 71.52 109.552 -177.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -118.76 164.41 15.42 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.527 0.731 . . . . 55.55 109.77 -176.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -153.83 80.62 1.15 Allowed 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 107.925 -1.139 . . . . 74.2 107.925 175.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 C--O 1.25 1.121 0 C-N-CA 124.159 0.984 . . . . 64.23 109.473 -175.08 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 35.3 ttp . . . . . 0 N--CA 1.479 1.021 0 CA-C-O 118.315 -0.85 . . . . 70.44 111.748 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -42.49 -56.71 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 113.836 1.05 . . . . 74.0 113.836 -167.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -61.33 -40.0 92.6 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.821 0.448 . . . . 63.44 112.08 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.562 HD21 HD12 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -68.8 -38.18 79.76 Favored 'General case' 0 N--CA 1.48 1.044 0 CA-C-O 121.284 0.564 . . . . 72.11 109.66 -177.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -68.61 -34.48 75.85 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.081 0.952 . . . . 73.45 108.932 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.6 m170 -66.31 -37.94 86.56 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.93 0.492 . . . . 74.3 110.426 177.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 85.9 mt -57.21 -50.59 76.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.781 0.832 . . . . 64.13 110.52 171.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.617 HG23 ' HG2' ' A' ' 43' ' ' GLU . 19.5 mm -63.25 -42.85 97.95 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.841 0 CA-C-N 115.668 -0.696 . . . . 72.04 111.305 -178.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -63.53 -51.79 63.97 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 123.848 0.859 . . . . 63.01 110.471 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.434 HD11 ' HE2' ' A' ' 66' ' ' LYS . 82.4 mt -59.22 -53.0 63.28 Favored 'General case' 0 C--O 1.216 -0.699 0 O-C-N 124.04 0.838 . . . . 73.1 110.49 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.456 ' HA2' HD12 ' A' ' 14' ' ' ILE . . . -57.53 -38.62 88.26 Favored Glycine 0 C--N 1.348 1.239 0 O-C-N 124.64 1.212 . . . . 73.23 113.9 -177.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.7 tp-100 -74.4 -43.68 55.3 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 122.536 -0.39 . . . . 53.23 110.666 -179.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 65.7 t -66.84 -24.32 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 122.546 0.339 . . . . 64.14 110.353 175.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.503 HG21 HG21 ' A' ' 35' ' ' VAL . 51.3 mt -64.43 -52.9 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.729 0.812 . . . . 62.02 108.913 171.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -54.34 -36.8 64.19 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 124.234 0.959 . . . . 73.42 111.25 177.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -72.04 -66.0 0.7 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.828 0.851 . . . . 75.14 111.34 178.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.45 ' HD2' HG13 ' A' ' 76' ' ' ILE . 9.7 ptp180 -68.34 -19.31 64.64 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.732 0.813 . . . . 44.13 112.564 -170.586 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 47.9 t -64.59 -29.85 70.87 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 122.751 0.42 . . . . 71.53 110.874 176.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.44 -6.43 24.74 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 112.522 0.564 . . . . 71.24 112.522 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -63.81 -28.43 69.86 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 119.424 -0.322 . . . . 74.51 110.797 169.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . 0.512 ' SD ' HD11 ' A' ' 85' ' ' ILE . 3.2 mmt -65.66 94.57 0.2 Allowed 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 108.982 -0.748 . . . . 71.34 108.982 176.41 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -72.88 -26.69 61.53 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.816 0.817 . . . . 65.24 110.123 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' HD22 ' A' ' 151' ' ' LEU . 92.7 m-85 -93.88 -174.25 3.38 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 113.413 -1.721 . . . . 70.32 109.265 166.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' HG ' ' HD2' ' A' ' 148' ' ' PHE . 56.8 m 54.32 53.9 10.24 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.814 0.845 . . . . 71.21 112.8 174.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -58.0 -52.45 65.48 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.963 0.905 . . . . 73.33 112.14 -175.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.515 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 19.3 tptm -68.19 -47.83 66.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.279 -0.873 . . . . 75.15 110.993 -173.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 30' ' ' ARG . 19.1 mt-30 -73.02 -25.48 60.97 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.788 0.662 . . . . 75.0 112.788 -178.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 42.4 t -71.19 -49.44 43.67 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.99 0.516 . . . . 65.53 110.271 176.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -73.35 -22.0 60.4 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.425 -0.807 . . . . 74.42 111.053 177.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.826 HH12 ' HB2' ' A' ' 98' ' ' PHE . 19.1 ttt-85 -63.12 -52.93 60.6 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.314 1.046 . . . . 75.54 110.043 169.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.0 tp -58.87 -49.42 77.82 Favored 'General case' 0 C--N 1.359 1.011 0 O-C-N 123.843 0.714 . . . . 63.23 109.705 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.22 -41.14 96.6 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 124.301 1.001 . . . . 51.32 112.895 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -63.12 -49.12 75.68 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.879 0.872 . . . . 72.0 111.019 -179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.487 ' O ' ' HG ' ' A' ' 38' ' ' LEU . 84.1 mtt-85 -61.56 -56.37 20.72 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.053 0.846 . . . . 72.33 110.716 179.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.503 HG21 HG21 ' A' ' 14' ' ' ILE . 58.6 t -56.23 -46.44 81.38 Favored 'Isoleucine or valine' 0 C--N 1.349 0.546 0 O-C-N 124.296 0.997 . . . . 73.31 111.407 -177.04 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.537 HD23 HD11 ' A' ' 39' ' ' ILE . 72.3 mt -62.77 -40.98 98.97 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 123.443 0.465 . . . . 73.33 111.25 177.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -64.29 -27.56 71.78 Favored Glycine 0 CA--C 1.532 1.114 0 O-C-N 123.379 0.425 . . . . 75.42 112.951 177.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.586 ' HB3' ' HZ ' ' A' ' 65' ' ' PHE . 47.9 mt -84.52 -47.75 10.28 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.305 0.642 . . . . 64.54 111.481 179.695 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.537 HD11 HD23 ' A' ' 36' ' ' LEU . 22.4 pt -76.83 -40.28 31.64 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.357 0 CA-C-O 117.807 -1.092 . . . . 73.53 111.409 -171.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.4 tptm -54.39 -47.79 96.61 Favored Pre-proline 0 N--CA 1.493 1.675 0 N-CA-C 113.553 0.946 . . . . 75.15 113.553 -169.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.38 -48.01 23.81 Favored 'Trans proline' 0 C--N 1.401 3.315 0 C-N-CA 122.003 1.802 . . . . 53.54 111.395 171.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.562 HD12 HD21 ' A' ' 4' ' ' LEU . 4.3 mm? -69.89 -25.23 63.6 Favored 'General case' 0 C--O 1.211 -0.926 0 O-C-N 124.087 0.867 . . . . 63.13 111.474 -177.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.617 ' HG2' HG23 ' A' ' 8' ' ' ILE . 43.4 mt-10 -67.22 -52.08 45.49 Favored 'General case' 0 C--N 1.354 0.783 0 N-CA-C 108.544 -0.91 . . . . 62.21 108.544 178.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 70.6 mtm -57.63 -45.85 84.9 Favored 'General case' 0 C--N 1.351 0.668 0 O-C-N 124.211 0.944 . . . . 54.44 110.306 177.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.9 mt -71.62 -21.57 61.82 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.732 0.813 . . . . 65.31 112.607 -178.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.65 -53.11 7.95 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.581 0.753 . . . . 63.42 109.807 178.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -67.06 -38.89 86.62 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 123.681 0.613 . . . . 52.24 111.361 -179.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 22.6 mt-30 -71.84 -32.79 67.87 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.112 0.565 . . . . 75.35 110.627 174.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -88.51 66.53 3.18 Favored Glycine 0 C--N 1.348 1.245 0 N-CA-C 111.871 -0.492 . . . . 62.12 111.871 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -63.01 -35.93 81.86 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.721 0.808 . . . . 61.23 110.398 176.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.49 138.03 52.08 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.063 -0.717 . . . . 73.32 109.063 170.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.9 m -151.86 168.5 24.92 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.841 1.256 . . . . 70.23 108.56 -179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.5 t -105.54 98.32 16.88 Favored Pre-proline 0 CA--C 1.543 0.686 0 N-CA-C 108.86 -0.793 . . . . 54.22 108.86 171.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.623 ' HA ' HD23 ' A' ' 58' ' ' LEU . 6.1 Cg_exo -73.93 95.26 0.89 Allowed 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.218 1.946 . . . . 74.13 110.027 174.406 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 46.8 t -62.3 160.8 12.5 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.826 -0.625 . . . . 42.31 109.91 175.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -59.94 -50.7 72.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.967 0.507 . . . . 75.34 110.741 -175.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -28.84 67.13 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 115.637 -0.71 . . . . 53.32 112.051 177.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.623 HD23 ' HA ' ' A' ' 54' ' ' PRO . 33.4 tp -66.72 -48.89 67.77 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 122.903 0.481 . . . . 71.1 110.047 177.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 58.8 m -60.52 -43.36 97.18 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 124.189 0.931 . . . . 74.41 110.136 178.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 92.2 m -56.46 -47.65 78.71 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 123.793 0.683 . . . . 53.13 110.959 176.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.4 -42.44 98.77 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.373 0.669 . . . . 72.44 111.439 179.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.47 ' SD ' HD11 ' A' ' 112' ' ' LEU . 23.1 mmt -64.71 -34.09 77.49 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.292 0.637 . . . . 75.43 111.266 178.437 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -73.72 -35.29 65.09 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.218 0.607 . . . . 70.41 110.653 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 69.4 mtp85 -66.06 -39.58 90.21 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.688 0.795 . . . . 65.4 110.27 175.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.586 ' HZ ' ' HB3' ' A' ' 38' ' ' LEU . 3.3 t80 -70.76 -42.45 70.43 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.188 0.995 . . . . 73.21 110.234 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.434 ' HE2' HD11 ' A' ' 10' ' ' LEU . 14.7 tmtt? -64.72 -38.92 92.63 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.48 1.112 . . . . 75.2 110.053 176.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -65.8 -40.6 92.05 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.381 0.673 . . . . 72.02 111.009 178.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.41 -35.67 80.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.385 0.674 . . . . 73.23 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 90.4 mt -72.09 -26.09 62.01 Favored 'General case' 0 CA--C 1.541 0.63 0 CA-C-N 115.786 -0.643 . . . . 75.1 111.067 174.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -70.72 -34.37 71.84 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.906 0.482 . . . . 72.14 110.351 172.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.505 ' HB3' HG22 ' A' ' 101' ' ' VAL . 25.3 mm-40 -64.13 -44.46 92.14 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 115.985 -0.552 . . . . 65.12 110.878 175.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.5 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -63.29 -59.72 4.34 Favored 'General case' 0 C--N 1.354 0.796 0 O-C-N 123.454 0.471 . . . . 53.13 110.555 174.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -47.64 -46.35 28.8 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 126.019 1.728 . . . . 73.43 111.875 -176.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -67.2 -44.05 87.59 Favored Glycine 0 C--N 1.348 1.247 0 O-C-N 124.471 1.107 . . . . 60.34 113.416 -176.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.479 ' HB2' ' CE2' ' A' ' 98' ' ' PHE . 25.4 mt-10 -67.06 -48.36 68.49 Favored 'General case' 0 C--O 1.214 -0.782 0 CA-C-O 118.294 -0.86 . . . . 72.43 111.028 -178.182 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.605 ' HA ' ' HB2' ' A' ' 79' ' ' PHE . 1.8 pt -66.37 -26.77 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.233 0 CA-C-N 118.704 0.684 . . . . 73.14 111.678 176.519 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -60.77 -40.96 94.48 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.11 0.564 . . . . 72.04 110.232 171.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 29.4 mtmm -85.39 -22.65 28.29 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.874 0.694 . . . . 74.24 112.874 175.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.605 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 9.2 m-85 -79.33 -1.63 37.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.549 0.74 . . . . 71.35 111.68 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 59.4 p -56.74 -26.33 56.91 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 123.424 0.689 . . . . 63.51 110.775 172.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -82.73 112.4 19.55 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 107.548 -1.278 . . . . 75.32 107.548 162.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.496 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.7 mpt_? -70.78 -23.69 62.44 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.069 0.548 . . . . 62.02 110.821 -175.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 25.5 m -63.73 -33.97 76.85 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.158 0.983 . . . . 61.01 111.66 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 -57.09 -45.82 83.04 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.157 0.983 . . . . 51.43 110.075 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.512 HD11 ' SD ' ' A' ' 21' ' ' MET . 21.1 mt -60.79 -54.82 29.99 Favored 'Isoleucine or valine' 0 C--N 1.352 0.694 0 O-C-N 124.248 0.967 . . . . 75.34 109.869 -177.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 27.5 t -57.18 -38.03 73.01 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.585 0.553 . . . . 74.31 111.678 -179.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.0 tpt180 -63.18 -47.93 80.53 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 124.184 0.927 . . . . 74.53 111.243 -176.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.95 -29.88 50.09 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 110.096 -0.335 . . . . 71.32 110.096 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 85' ' ' ILE . 11.7 tp -69.04 -39.05 79.42 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.934 0.894 . . . . 71.03 110.254 -172.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 13.1 t -78.01 -27.59 48.97 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.346 0.659 . . . . 43.33 110.84 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -80.72 -55.39 4.86 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.519 0.728 . . . . 52.3 111.189 -175.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 25.2 t -85.2 130.5 34.59 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 108.834 -0.802 . . . . 53.15 108.834 175.1 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 68.6 mm-40 -92.86 -11.94 32.28 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.504 0.722 . . . . 73.04 112.4 -170.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -146.73 4.46 0.87 Allowed 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.32 0.859 . . . . 74.32 113.32 -176.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -72.63 102.24 3.24 Favored 'General case' 0 C--N 1.354 0.777 0 N-CA-C 107.719 -1.215 . . . . 75.2 107.719 169.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.475 HG23 ' HB2' ' A' ' 141' ' ' ALA . 3.3 mm -58.23 146.77 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.909 0 N-CA-C 106.531 -1.655 . . . . 75.43 106.531 168.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 97' ' ' LEU . 0.2 OUTLIER -39.9 -48.25 2.29 Favored 'General case' 0 N--CA 1.502 2.137 0 C-N-CA 124.158 0.983 . . . . 71.53 111.925 -173.008 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.826 ' HB2' HH12 ' A' ' 30' ' ' ARG . 72.7 m-85 -128.42 47.44 2.44 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.06 0.944 . . . . 70.45 111.256 176.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.1 -62.13 1.85 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 124.418 1.087 . . . . 71.32 111.571 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -64.07 -42.55 96.94 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.174 -1.375 . . . . 71.15 110.76 -175.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 71' ' ' GLU . 61.3 t -63.21 -41.72 93.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 114.829 -1.078 . . . . 74.22 111.498 -178.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -71.65 -32.94 68.47 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.351 0.66 . . . . 71.5 110.578 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -63.4 -41.38 98.75 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 108.904 -0.776 . . . . 73.13 108.904 174.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . 0.411 ' HD2' ' HA ' ' A' ' 101' ' ' VAL . 60.3 mttm -63.37 -49.1 75.19 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 115.575 -0.739 . . . . 60.51 110.683 174.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.81 -42.21 97.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.938 0.895 . . . . 74.42 111.22 -178.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.462 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 37.4 t -71.12 -47.79 55.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.054 0.846 . . . . 52.12 110.198 -176.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.569 ' HA ' ' HE2' ' A' ' 110' ' ' LYS . 27.3 t70 -57.82 -57.2 13.81 Favored 'General case' 0 C--N 1.358 0.956 0 O-C-N 124.051 0.844 . . . . 64.43 110.381 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 67.9 t -64.1 -38.59 82.85 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.875 0 CA-C-N 114.945 -1.025 . . . . 63.21 111.272 -178.037 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 45.4 t-105 -60.46 -42.06 95.42 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 118.189 0.45 . . . . 74.11 111.221 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.569 ' HE2' ' HA ' ' A' ' 107' ' ' ASP . 42.5 mtmt -58.91 -57.0 15.01 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 109.665 -0.494 . . . . 73.52 109.665 174.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -53.66 -44.56 69.76 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.569 0.748 . . . . 74.45 111.784 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.47 HD11 ' SD ' ' A' ' 62' ' ' MET . 9.1 tt -70.21 -55.94 8.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.292 1.437 . . . . 53.32 109.885 -172.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.0 t -61.87 -31.64 71.92 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.836 0.855 . . . . 74.04 111.326 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 51.5 mt -70.24 -51.16 32.83 Favored 'General case' 0 C--N 1.355 0.848 0 C-N-CA 122.963 0.505 . . . . 71.23 111.031 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.4 pp -67.87 -24.3 65.23 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.047 0.385 . . . . 74.43 110.497 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.651 HD22 ' SD ' ' A' ' 122' ' ' MET . 42.2 mt -64.53 -55.51 20.13 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-O 119.239 -0.41 . . . . 52.53 110.415 172.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -68.77 -32.8 72.81 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 112.438 0.533 . . . . 74.02 112.438 -174.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 84.6 t -80.9 -60.92 1.93 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 123.131 0.572 . . . . 73.11 110.802 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -84.21 -55.93 3.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.251 0.62 . . . . 72.31 111.748 -169.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.511 HE21 ' HA ' ' A' ' 116' ' ' LEU . 2.4 mp0 -82.86 -5.36 58.95 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 122.575 0.35 . . . . 70.43 111.723 -178.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 79.6 mtt-85 62.74 25.33 15.05 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.803 1.241 . . . . 73.41 112.344 172.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.651 ' SD ' HD22 ' A' ' 116' ' ' LEU . 69.4 mtp -84.81 126.31 68.66 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.239 1.016 . . . . 63.03 109.998 -179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_endo -80.0 59.12 7.3 Favored 'Trans proline' 0 C--N 1.374 1.915 0 C-N-CA 123.086 2.524 . . . . 61.12 113.44 -172.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . . . . . . . . . 5.2 m -104.22 117.73 50.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.99 0.916 . . . . 72.43 109.814 177.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 33.5 t -165.94 52.76 0.27 Allowed Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.974 1.31 . . . . 73.31 108.551 173.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -79.25 -3.75 13.29 Favored 'Trans proline' 0 C--N 1.382 2.329 0 C-N-CA 122.143 1.895 . . . . 74.21 112.605 -172.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 15.1 tt -122.89 131.12 73.86 Favored 'Isoleucine or valine' 0 C--O 1.243 0.734 0 C-N-CA 124.125 0.97 . . . . 70.44 108.549 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 26.8 t -87.27 86.48 7.27 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.702 -0.851 . . . . 71.25 108.702 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 75.09 -67.85 0.23 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 125.42 1.488 . . . . 74.2 112.677 177.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 112.3 25.01 4.86 Favored Glycine 0 C--N 1.349 1.274 0 CA-C-O 120.196 -0.224 . . . . 54.14 113.353 -178.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -73.37 -31.44 63.93 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.296 0.638 . . . . 74.24 110.508 176.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 33.7 m -65.61 -31.28 72.22 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.803 0.841 . . . . 61.44 111.159 173.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -64.68 -18.38 64.92 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.451 1.1 . . . . 73.22 112.381 -179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -71.75 -42.3 67.39 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.927 0.491 . . . . 45.24 110.669 173.633 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -69.27 -31.22 69.6 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 115.829 -0.623 . . . . 75.21 111.046 -177.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -55.72 -58.56 7.31 Favored 'General case' 0 C--O 1.211 -0.974 0 O-C-N 124.062 0.851 . . . . 62.44 110.407 178.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -55.63 -42.51 75.06 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 113.926 1.084 . . . . 75.4 113.926 -173.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -70.0 -39.97 75.56 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 123.104 0.253 . . . . 75.44 110.857 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . 0.474 HE21 ' HG3' ' A' ' 143' ' ' GLU . 22.6 tp60 -70.96 -35.43 72.16 Favored 'General case' 0 C--N 1.359 1.0 0 O-C-N 123.099 0.249 . . . . 74.54 110.928 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -64.63 -56.42 13.94 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 108.986 -0.746 . . . . 40.13 108.986 179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.475 ' HB2' HG23 ' A' ' 96' ' ' ILE . . . -58.11 -36.8 73.42 Favored 'General case' 0 C--O 1.22 -0.483 0 O-C-N 124.399 1.062 . . . . 34.34 111.95 178.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -56.93 -64.09 0.99 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 122.868 0.467 . . . . 64.34 110.155 177.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.474 ' HG3' HE21 ' A' ' 139' ' ' GLN . 45.5 mt-10 -63.69 -38.41 91.0 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.979 0.912 . . . . 75.43 111.922 -174.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.515 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 18.2 t0 -86.01 -45.19 11.68 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.385 -0.825 . . . . 73.51 111.942 -165.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.432 ' HG3' ' HG ' ' A' ' 89' ' ' LEU . 54.4 ttt-85 -65.45 -36.68 84.64 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 109.406 -0.59 . . . . 64.23 109.406 175.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 38.5 ttt180 -63.58 -44.45 94.02 Favored 'General case' 0 C--N 1.356 0.887 0 CA-C-N 116.013 -0.539 . . . . 72.22 110.514 173.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.609 ' HB1' ' HE ' ' A' ' 153' ' ' ARG . . . -72.36 -19.53 61.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.261 0.624 . . . . 63.33 112.576 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.482 ' HD2' ' HG ' ' A' ' 24' ' ' CYS . 0.7 OUTLIER -78.21 -60.47 2.36 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 109.138 -0.69 . . . . 63.23 109.138 176.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -70.39 -26.01 63.5 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.06 -0.973 . . . . 73.23 110.891 -173.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 41.9 ttp -117.31 56.85 0.81 Allowed 'General case' 0 C--O 1.242 0.659 0 N-CA-C 107.388 -1.338 . . . . 73.13 107.388 173.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.406 HD22 ' CE1' ' A' ' 23' ' ' TYR . 59.9 tp -65.79 113.72 4.53 Favored 'General case' 0 C--N 1.351 0.673 0 CA-C-N 115.512 -0.767 . . . . 70.41 109.452 174.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 56.1 ttt180 -164.41 -76.24 0.03 OUTLIER 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 107.347 -1.353 . . . . 72.24 107.347 -174.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.609 ' HE ' ' HB1' ' A' ' 147' ' ' ALA . 1.7 mpt_? 55.22 -85.8 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.301 1.04 . . . . 72.32 110.332 -176.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -120.35 -43.45 2.51 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.081 -1.081 . . . . 75.44 108.081 170.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 8.3 t30 67.06 140.18 0.03 OUTLIER 'General case' 0 C--N 1.365 1.267 0 C-N-CA 125.682 1.593 . . . . 55.22 111.639 178.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 . . . . . 0 CA--C 1.551 1.015 0 N-CA-C 108.034 -1.098 . . . . 73.53 108.034 172.166 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.523 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 108.421 -0.955 . . . . 51.04 108.421 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -71.18 -43.27 67.79 Favored 'General case' 0 C--N 1.357 0.929 0 CA-C-N 115.715 -0.675 . . . . 74.04 110.339 -175.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -57.3 -51.16 70.51 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 109.432 -0.581 . . . . 73.32 109.432 174.046 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.523 ' HB2' ' HB3' ' A' ' 1' ' ' MET . 4.3 mm? -56.37 -39.82 73.55 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.785 0.834 . . . . 61.43 111.247 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -61.52 -51.32 69.1 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 108.462 -0.94 . . . . 62.22 108.462 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -59.37 -52.75 64.27 Favored 'General case' 0 C--O 1.215 -0.725 0 O-C-N 123.788 0.68 . . . . 70.31 110.71 -177.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.451 HG22 HD12 ' A' ' 8' ' ' ILE . 97.7 mt -52.92 -55.01 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.397 1.479 . . . . 62.0 112.365 -178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.451 HD12 HG22 ' A' ' 7' ' ' ILE . 1.7 mp -67.67 -36.88 77.5 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 124.046 0.938 . . . . 72.02 110.959 -175.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 54.6 m -65.75 -46.03 80.36 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.343 0.657 . . . . 62.43 110.411 175.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 52.1 mt -57.79 -44.44 86.27 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 123.72 0.808 . . . . 61.22 109.736 178.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.463 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -60.29 -53.4 45.94 Favored Glycine 0 C--N 1.347 1.164 0 O-C-N 124.251 0.969 . . . . 73.03 113.052 -179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.466 ' HG3' HD12 ' A' ' 39' ' ' ILE . 33.5 mt-30 -66.41 -31.95 73.03 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 112.033 0.383 . . . . 74.1 112.033 179.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.9 t -70.36 -36.92 68.98 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 123.331 0.653 . . . . 70.32 110.723 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.413 HG21 HG21 ' A' ' 35' ' ' VAL . 37.3 mt -58.77 -49.24 83.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.641 0.776 . . . . 72.24 109.056 175.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -56.47 -52.9 62.96 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 114.695 -1.139 . . . . 71.53 111.343 178.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -60.7 -57.61 11.95 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 123.799 0.687 . . . . 73.11 111.053 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -73.58 -17.19 61.21 Favored 'General case' 0 N--CA 1.488 1.475 0 N-CA-C 112.683 0.623 . . . . 75.12 112.683 -173.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 28' ' ' CYS . 45.7 t -60.41 -17.11 41.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.147 0.579 . . . . 71.21 111.578 170.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -55.13 -23.38 20.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.514 0.726 . . . . 74.45 112.175 172.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -66.02 -15.6 63.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.456 0.702 . . . . 64.13 112.036 178.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.0 mmt -78.14 82.69 4.46 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 108.858 -0.793 . . . . 71.41 108.858 175.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -70.21 -35.45 73.9 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.781 -1.192 . . . . 65.42 107.781 173.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.423 ' HE2' HD22 ' A' ' 151' ' ' LEU . 70.7 m-85 -97.03 177.16 5.7 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 114.656 -1.156 . . . . 61.42 109.569 165.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 70.9 m 54.53 58.11 5.18 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.772 0.796 . . . . 74.15 109.835 -173.175 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -70.1 -49.83 46.9 Favored 'General case' 0 C--O 1.247 0.964 0 CA-C-N 114.255 -1.339 . . . . 75.4 110.872 -169.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.541 ' HB3' ' HB3' ' A' ' 140' ' ' ASP . 24.0 mmtp -61.1 -46.61 89.91 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 108.495 -0.928 . . . . 73.3 108.495 177.27 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.42 HE21 ' HB2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -57.66 -36.09 71.43 Favored 'General case' 0 N--CA 1.478 0.946 0 O-C-N 124.343 1.027 . . . . 72.22 113.441 179.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.433 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 40.7 t -70.9 -42.32 70.1 Favored 'General case' 0 N--CA 1.475 0.816 0 O-C-N 123.405 0.44 . . . . 74.23 110.667 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -71.71 -28.3 63.6 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-N 115.71 -0.677 . . . . 73.32 110.945 177.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.698 ' HD2' ' HB3' ' A' ' 136' ' ' GLU . 33.7 ttp180 -82.6 -38.05 24.15 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.489 1.116 . . . . 73.44 109.788 -173.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 61.2 tp -65.75 -43.39 89.08 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 108.178 -1.045 . . . . 74.24 108.178 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -60.93 -35.36 90.37 Favored Glycine 0 C--N 1.351 1.398 0 O-C-N 123.753 0.658 . . . . 34.23 112.745 173.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.4 t-80 -64.78 -51.52 61.83 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.344 0.658 . . . . 74.53 110.742 177.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.1 mtt-85 -57.6 -59.49 5.11 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.609 -1.178 . . . . 74.11 110.155 179.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.413 HG21 HG21 ' A' ' 14' ' ' ILE . 54.6 t -58.86 -52.38 61.0 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.541 0 O-C-N 124.668 1.23 . . . . 73.35 112.05 -174.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.28 -45.87 82.69 Favored 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 118.046 0.384 . . . . 63.34 110.349 -177.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -62.41 -24.49 65.79 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 123.258 0.349 . . . . 53.11 113.494 175.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.458 ' O ' HD23 ' A' ' 42' ' ' LEU . 11.4 tp -86.84 -40.15 15.18 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.577 1.151 . . . . 52.44 112.071 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.466 HD12 ' HG3' ' A' ' 12' ' ' GLN . 15.6 pt -84.6 -33.76 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-O 119.275 -0.393 . . . . 74.03 111.792 -171.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt -54.3 -53.76 55.6 Favored Pre-proline 0 N--CA 1.49 1.542 0 CA-C-O 117.992 -1.004 . . . . 71.21 113.131 -178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.773 ' HB2' ' SD ' ' A' ' 122' ' ' MET . 20.8 Cg_endo -57.68 -38.66 92.5 Favored 'Trans proline' 0 C--N 1.396 3.053 0 C-N-CA 122.218 1.945 . . . . 43.22 112.243 179.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.458 HD23 ' O ' ' A' ' 38' ' ' LEU . 4.5 mm? -66.64 -36.34 82.34 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 115.609 -0.723 . . . . 71.24 111.296 178.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -73.53 -29.42 62.45 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.913 0.885 . . . . 71.41 111.666 178.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 24.7 mmt -64.9 -33.39 75.91 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.828 0.451 . . . . 61.1 111.336 178.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.6 mt -86.38 -41.5 14.43 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.572 0.349 . . . . 73.33 111.773 171.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -58.86 -45.82 89.21 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.543 0.737 . . . . 75.42 111.95 -173.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -87.05 -20.75 26.72 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.435 0.694 . . . . 72.12 111.167 -171.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -102.58 -59.87 1.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.086 -0.506 . . . . 72.13 110.385 -172.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . -116.89 85.28 0.39 Allowed Glycine 0 C--N 1.343 0.951 0 CA-C-N 115.79 -0.641 . . . . 42.31 111.598 -179.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.06 95.66 0.17 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 109.518 -0.549 . . . . 74.24 109.518 178.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.413 ' O ' ' HE2' ' A' ' 1' ' ' MET . 22.3 mmt180 -68.77 90.24 0.41 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.864 0.866 . . . . 63.11 110.586 -178.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 21.3 m -71.85 -7.29 47.52 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 114.348 -1.296 . . . . 71.14 112.446 -175.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.3 t -113.06 90.19 15.47 Favored Pre-proline 0 CA--C 1.554 1.112 0 N-CA-C 108.432 -0.951 . . . . 63.44 108.432 169.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.445 ' HA ' HD23 ' A' ' 58' ' ' LEU . 96.0 Cg_endo -89.34 112.51 0.56 Allowed 'Trans proline' 0 C--N 1.374 1.913 0 C-N-CA 122.423 2.082 . . . . 64.15 111.113 173.557 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.2 p -62.44 156.45 22.69 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.953 0.501 . . . . 71.34 110.197 176.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -54.21 -51.78 63.34 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.634 0.774 . . . . 74.35 110.85 -178.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -55.85 -38.73 70.45 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.932 0.893 . . . . 70.32 112.351 178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.48 ' O ' ' HG2' ' A' ' 62' ' ' MET . 62.0 tp -67.65 -51.89 44.56 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 124.059 0.944 . . . . 73.12 109.275 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 51.3 m -61.64 -36.69 81.51 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.281 1.032 . . . . 55.53 111.521 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.8 m -66.67 -47.78 71.4 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.334 0.654 . . . . 71.11 109.382 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 65' ' ' PHE . . . -56.43 -41.29 76.15 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.722 -0.672 . . . . 75.34 110.178 175.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' LEU . 25.1 mmt -67.25 -28.45 68.05 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.987 0.915 . . . . 70.14 111.934 177.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -70.29 -49.08 53.35 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 122.84 0.456 . . . . 54.22 110.767 178.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -68.19 -33.77 75.06 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 120.529 0.204 . . . . 74.41 110.562 177.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.445 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 1.8 t80 -61.1 -56.25 23.03 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.945 1.298 . . . . 75.11 109.674 -179.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 70' ' ' GLU . 48.8 tttm -55.77 -50.06 71.46 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 114.224 -1.353 . . . . 74.15 110.695 175.437 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -54.47 -49.86 69.08 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.104 0.961 . . . . 63.1 112.15 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -71.34 -28.85 64.37 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.412 0.685 . . . . 62.33 111.722 -177.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 84.4 mt -75.64 -28.18 58.67 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.718 0.407 . . . . 74.32 111.696 173.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 66' ' ' LYS . 51.4 mt-10 -69.92 -42.69 72.99 Favored 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 109.445 -0.576 . . . . 63.34 109.445 174.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 42.4 mt-10 -63.66 -45.38 90.42 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 114.979 -1.009 . . . . 72.32 110.354 176.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.24 -43.6 98.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.278 0.631 . . . . 71.34 111.39 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -57.8 -44.8 86.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.763 1.225 . . . . 64.45 110.265 177.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -68.23 -32.98 77.03 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 114.764 -1.107 . . . . 44.41 113.209 178.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 48.7 mm-40 -68.0 -51.06 51.53 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 116.915 0.357 . . . . 72.22 110.866 -179.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.557 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 0.4 OUTLIER -66.44 -28.79 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 118.269 0.486 . . . . 74.42 112.284 175.541 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -60.74 -41.71 95.93 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 108.867 -0.79 . . . . 52.05 108.867 172.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -69.25 -39.61 78.36 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.842 1.257 . . . . 54.31 111.008 175.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.473 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 18.4 m-85 -81.46 5.45 17.67 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.996 0.918 . . . . 74.51 112.443 -174.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 87.9 p -56.7 -32.56 65.59 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.214 0.53 . . . . 65.41 110.199 171.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -86.99 117.56 25.79 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 114.922 -1.036 . . . . 70.23 109.209 168.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.576 ' HD2' ' H ' ' A' ' 82' ' ' ARG . 1.4 mpt_? -78.87 -26.17 43.94 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 124.229 1.012 . . . . 64.13 109.803 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 16.5 m -61.26 -38.65 87.45 Favored 'General case' 0 CA--C 1.553 1.066 0 C-N-CA 123.92 0.888 . . . . 65.14 110.601 172.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -60.64 -44.26 96.59 Favored 'General case' 0 C--O 1.257 1.45 0 C-N-CA 124.265 1.026 . . . . 75.42 110.595 175.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.449 HG12 ' CD1' ' A' ' 79' ' ' PHE . 19.6 mt -60.93 -54.86 29.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.88 0 CA-C-N 115.091 -0.958 . . . . 62.42 109.611 179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 47.8 t -54.66 -43.05 72.06 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.556 0.743 . . . . 63.51 111.235 -177.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 49.3 ttm-85 -56.67 -54.98 39.83 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 124.508 1.13 . . . . 74.12 111.362 178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.479 ' HZ ' ' HA ' ' A' ' 97' ' ' LEU . 0.1 OUTLIER -76.18 -26.32 56.07 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-N 116.508 -0.314 . . . . 74.21 110.541 -176.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 21.4 tp -71.24 -43.72 66.73 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 124.077 0.951 . . . . 71.22 110.701 -170.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.6 t -65.08 -19.81 66.17 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.074 -0.966 . . . . 73.14 110.805 177.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.55 -26.97 14.24 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.312 1.045 . . . . 71.44 112.175 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 90.9 p -74.38 118.18 17.04 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.774 0.429 . . . . 62.33 110.255 -172.174 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . 0.428 ' H ' ' NE2' ' A' ' 93' ' ' GLN . 0.2 OUTLIER -68.89 -30.61 69.14 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.31 0.644 . . . . 71.21 110.341 -178.765 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.465 ' HB3' ' HD3' ' A' ' 99' ' ' LYS . 4.9 m-20 -65.12 -41.48 94.82 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 114.317 -1.31 . . . . 75.3 109.917 176.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.584 ' HD2' ' HD2' ' A' ' 145' ' ' ARG . 6.2 mtmp? 67.06 12.47 8.99 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.843 1.257 . . . . 74.05 111.066 -175.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.669 ' HB ' ' HB2' ' A' ' 99' ' ' LYS . 12.9 mt -125.42 119.87 56.41 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 107.984 -1.117 . . . . 63.22 107.984 -178.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.479 ' HA ' ' HZ ' ' A' ' 88' ' ' PHE . 7.1 mp -53.26 -39.22 63.69 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.699 1.599 . . . . 73.11 112.2 175.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.557 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 81.6 m-85 -122.87 35.07 4.96 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.331 0.653 . . . . 72.11 111.16 -173.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.669 ' HB2' ' HB ' ' A' ' 96' ' ' ILE . 38.3 tttm -63.3 -52.42 62.01 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.066 0.848 . . . . 63.43 110.45 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -75.02 -37.63 61.72 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.653 -0.703 . . . . 61.11 110.737 -175.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 43.3 t -68.69 -39.08 79.81 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 122.598 0.359 . . . . 75.34 110.814 -179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -77.4 -25.33 50.72 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.082 0.553 . . . . 64.32 110.767 176.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -61.71 -43.93 97.9 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.63 -0.507 . . . . 64.44 109.63 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.32 -58.68 7.41 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 109.375 -0.602 . . . . 75.32 109.375 171.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 82.4 mt -54.42 -32.55 57.61 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.823 0.849 . . . . 62.24 112.466 -177.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 40.9 t -78.36 -47.1 18.39 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 123.631 0.772 . . . . 71.23 111.237 -176.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.652 ' HA ' ' HD3' ' A' ' 110' ' ' LYS . 22.5 t70 -69.34 -41.36 76.75 Favored 'General case' 0 C--O 1.257 1.496 0 CA-C-O 121.427 0.632 . . . . 53.22 110.436 -177.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.18 -48.54 86.52 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 CA-C-N 114.792 -1.095 . . . . 74.45 109.706 171.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.602 ' HE3' HD23 ' A' ' 112' ' ' LEU . 10.6 t-105 -63.15 -25.62 68.43 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.333 0.653 . . . . 72.45 112.119 178.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.652 ' HD3' ' HA ' ' A' ' 107' ' ' ASP . 43.6 mtpt -63.66 -63.05 1.28 Allowed 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 108.701 -0.851 . . . . 74.24 108.701 171.83 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -54.33 -47.23 72.75 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.91 0.862 . . . . 73.31 110.679 -177.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 109' ' ' TRP . 47.5 tp -60.11 -56.25 23.89 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 112.902 -1.954 . . . . 61.12 110.529 -177.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.428 ' HB2' HG11 ' A' ' 124' ' ' VAL . 91.3 p -61.25 -33.86 74.21 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.562 0.345 . . . . 72.52 111.843 -176.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 96.3 mt -63.33 -54.86 30.32 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 123.814 0.696 . . . . 72.12 110.134 176.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.8 pp -69.38 -23.7 63.77 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 111.84 0.311 . . . . 75.32 111.84 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.443 HD13 ' SD ' ' A' ' 122' ' ' MET . 85.8 mt -70.78 -45.03 65.47 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 122.891 0.476 . . . . 55.23 111.28 174.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -79.29 -31.11 43.23 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 122.111 -0.368 . . . . 75.31 111.6 -175.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 76.3 t -83.47 -48.64 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 C-N-CA 122.7 0.4 . . . . 64.11 110.965 -179.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -90.85 -57.94 2.64 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.272 0.558 . . . . 64.52 111.22 -176.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -83.03 -0.76 50.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.577 -0.738 . . . . 73.42 111.644 -170.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 33.5 mmt180 62.26 24.16 14.35 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 125.156 1.382 . . . . 63.31 113.44 171.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.773 ' SD ' ' HB2' ' A' ' 41' ' ' PRO . 49.1 ttm -78.06 131.66 69.15 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 123.936 0.894 . . . . 72.42 110.396 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -77.25 96.97 1.12 Allowed 'Trans proline' 0 C--N 1.378 2.082 0 C-N-CA 122.127 1.885 . . . . 62.23 111.799 179.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 113' ' ' SER . 28.0 t -126.73 143.77 39.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.404 0.682 . . . . 74.33 109.382 177.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 47.5 t -163.55 -63.67 0.01 OUTLIER Pre-proline 0 CA--C 1.57 1.718 0 N-CA-C 112.857 0.688 . . . . 72.34 112.857 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.81 -14.56 26.84 Favored 'Trans proline' 0 C--N 1.392 2.832 0 C-N-CA 122.259 1.973 . . . . 71.14 114.073 -164.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 10.6 tt -110.53 -16.36 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.24 0 C-N-CA 124.222 1.009 . . . . 75.31 111.236 -171.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 19.6 m -64.93 -47.89 76.09 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.591 0.756 . . . . 73.31 110.613 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -58.43 -30.11 66.65 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 114.454 -1.248 . . . . 70.2 112.051 176.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 62.28 26.27 67.63 Favored Glycine 0 C--N 1.355 1.592 0 O-C-N 123.743 0.652 . . . . 74.02 113.702 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -66.93 -44.53 80.43 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.377 0.671 . . . . 75.44 110.476 -178.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 90.6 p -63.77 -50.85 67.42 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 115.401 -0.818 . . . . 72.23 109.842 173.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -52.19 -38.33 57.47 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.338 1.455 . . . . 75.01 113.364 -176.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.63 -55.28 16.01 Favored 'General case' 0 C--O 1.241 0.653 0 C-N-CA 123.155 0.582 . . . . 62.52 110.281 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -63.83 -29.41 70.61 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.186 -0.915 . . . . 73.02 111.7 -177.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.698 ' HB3' ' HD2' ' A' ' 30' ' ' ARG . 34.9 mt-10 -57.04 -60.46 3.56 Favored 'General case' 0 C--N 1.353 0.724 0 C-N-CA 124.706 1.202 . . . . 73.42 110.787 177.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.608 ' HB3' HD13 ' A' ' 96' ' ' ILE . 32.5 m-20 -56.36 -39.8 73.48 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 116.293 -0.412 . . . . 74.22 111.431 -176.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -65.23 -64.45 0.86 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 123.141 0.276 . . . . 73.52 111.043 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 47.4 tt0 -62.36 -50.54 71.17 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.571 0.701 . . . . 53.54 110.674 -173.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.541 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . 3.1 m-20 -75.48 -40.54 57.2 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.234 -1.348 . . . . 73.44 112.135 -167.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.523 ' HB2' HH22 ' A' ' 30' ' ' ARG . . . -74.36 -22.39 59.24 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 118.923 0.783 . . . . 60.34 111.269 177.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 146' ' ' ARG . 35.7 t70 -70.98 -34.5 71.46 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 109.76 -0.459 . . . . 72.52 109.76 169.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -68.62 -35.46 77.34 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.203 0.601 . . . . 63.45 111.199 173.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -72.38 -36.45 68.73 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.156 0.582 . . . . 73.35 110.467 178.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . 0.584 ' HD2' ' HD2' ' A' ' 95' ' ' LYS . 45.1 ttt180 -58.37 -45.56 88.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.657 -1.156 . . . . 71.53 109.958 171.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 142' ' ' ASP . 48.5 mtt180 -66.99 -39.9 87.24 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 116.104 -0.498 . . . . 72.22 110.321 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.439 ' O ' HD13 ' A' ' 151' ' ' LEU . . . -71.16 -23.01 61.98 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.287 0.635 . . . . 72.14 111.617 -177.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.454 ' HB3' HE21 ' A' ' 149' ' ' GLN . 0.1 OUTLIER -86.95 -60.5 1.96 Allowed 'General case' 0 N--CA 1.474 0.729 0 CA-C-O 121.415 0.626 . . . . 64.3 111.251 175.452 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . 0.454 HE21 ' HB3' ' A' ' 148' ' ' PHE . 33.1 mm-40 -82.69 -27.09 31.48 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-N 114.904 -1.044 . . . . 74.33 112.654 -165.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 39.1 ttm -100.04 -70.88 0.72 Allowed 'General case' 0 N--CA 1.481 1.092 0 N-CA-C 108.788 -0.819 . . . . 72.25 108.788 173.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . 0.439 HD13 ' O ' ' A' ' 147' ' ' ALA . 16.6 tp 63.1 162.73 0.1 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 125.221 1.409 . . . . 64.03 111.818 -179.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 50.2 ttp180 -151.72 70.82 0.96 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 108.338 -0.986 . . . . 72.22 108.338 174.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 mmt180 -171.16 -59.88 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.796 1.238 . . . . 64.33 107.926 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . 0.428 ' O ' HD23 ' A' ' 151' ' ' LEU . 26.8 t70 -126.4 163.71 22.69 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.233 1.013 . . . . 71.23 109.34 -175.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 26.8 p-10 -164.27 162.06 22.27 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.44 0.696 . . . . 54.21 110.031 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? . . . . . 0 CA--C 1.557 1.229 0 CA-C-O 118.646 -0.692 . . . . 74.2 111.331 177.872 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.745 0 CA-C-O 120.926 0.393 . . . . 72.51 110.146 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -68.04 -52.21 37.98 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 124.333 1.053 . . . . 64.3 110.109 -170.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -71.02 -29.28 65.16 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 114.692 -1.14 . . . . 74.52 110.842 179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.473 HD21 HD12 ' A' ' 42' ' ' LEU . 0.9 OUTLIER -73.59 -40.17 64.08 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 109.162 -0.681 . . . . 74.15 109.162 -179.196 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.447 ' O ' ' HD3' ' A' ' 5' ' ' LYS . 6.8 tmtt? -71.38 -30.98 66.77 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.305 -0.998 . . . . 75.23 108.305 176.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.498 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 57.5 t-80 -64.61 -40.61 95.8 Favored 'General case' 0 CA--C 1.546 0.797 0 CA-C-O 119.304 -0.379 . . . . 65.43 110.14 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 93.6 mt -56.83 -46.14 83.38 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 C-N-CA 124.262 1.025 . . . . 74.54 110.526 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.481 HD12 ' HG2' ' A' ' 43' ' ' GLU . 34.1 mm -54.54 -54.15 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 115.16 -0.927 . . . . 51.24 110.547 174.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.2 m -57.52 -40.1 78.03 Favored 'General case' 0 C--N 1.354 0.77 0 C-N-CA 124.409 1.084 . . . . 73.42 111.252 -178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 6' ' ' HIS . 93.4 mt -61.18 -57.9 10.53 Favored 'General case' 0 C--O 1.215 -0.749 0 O-C-N 123.923 0.764 . . . . 75.3 109.99 179.43 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.612 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -57.18 -36.04 73.17 Favored Glycine 0 C--N 1.345 1.069 0 O-C-N 124.65 1.219 . . . . 74.4 113.583 -176.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -62.8 -54.39 39.69 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 122.876 0.47 . . . . 63.5 110.904 175.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.1 t -65.62 -31.19 52.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.73 0.812 . . . . 61.45 111.269 -178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.549 HG23 HD11 ' A' ' 76' ' ' ILE . 36.5 mt -61.96 -60.12 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 124.612 1.165 . . . . 73.32 109.261 177.738 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -66.27 -27.83 68.24 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 123.249 0.343 . . . . 64.14 111.002 -177.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 13.7 tptt -63.46 -48.41 77.82 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.481 0.712 . . . . 73.23 110.55 177.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 9.8 ptp180 -83.93 -16.2 45.1 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.001 0.521 . . . . 54.33 111.888 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 42.6 t -66.27 -21.58 66.29 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.056 0.543 . . . . 72.54 110.354 172.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -63.78 -21.59 66.5 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.6 0.76 . . . . 65.52 111.855 172.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 34.3 mm-40 -68.33 -14.15 62.79 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.205 0.602 . . . . 74.54 112.47 179.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 9.4 mmt -77.07 85.34 3.57 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.088 0.47 . . . . 65.52 110.352 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.57 -40.79 76.55 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 108.673 -0.862 . . . . 72.42 108.673 167.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -106.81 164.82 11.79 Favored 'General case' 0 C--O 1.238 0.472 0 CA-C-N 114.484 -1.235 . . . . 72.35 109.216 170.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.625 ' SG ' HG21 ' A' ' 85' ' ' ILE . 29.3 m 58.93 53.26 5.78 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 124.342 1.026 . . . . 64.52 110.023 -167.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 7.4 mtpm? -73.84 -42.16 61.24 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.008 -1.451 . . . . 74.33 111.765 -170.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.482 ' HB3' ' HB2' ' A' ' 144' ' ' ASP . 22.5 tptp -74.33 -45.02 49.95 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.208 -0.905 . . . . 71.23 109.867 -170.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -76.23 -22.22 55.46 Favored 'General case' 0 N--CA 1.483 1.175 0 CA-C-N 116.026 -0.534 . . . . 70.3 111.24 176.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 t -61.57 -50.92 70.7 Favored 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 109.756 -0.461 . . . . 53.53 109.756 169.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -62.07 -38.7 89.82 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 124.181 0.925 . . . . 75.4 111.288 179.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HB3' HH21 ' A' ' 34' ' ' ARG . 4.1 mmp_? -51.06 -61.72 2.06 Favored 'General case' 0 N--CA 1.479 0.987 0 O-C-N 123.383 0.427 . . . . 64.31 110.01 172.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -56.62 -46.44 80.93 Favored 'General case' 0 N--CA 1.475 0.791 0 O-C-N 124.522 1.139 . . . . 71.31 110.887 -175.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.31 -49.89 58.94 Favored Glycine 0 C--N 1.341 0.857 0 O-C-N 123.967 0.792 . . . . 52.2 113.179 -176.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -59.36 -38.13 79.63 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.536 0.735 . . . . 61.35 111.261 179.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.564 HH21 ' HB3' ' A' ' 30' ' ' ARG . 14.5 mtt180 -60.44 -59.42 5.44 Favored 'General case' 0 N--CA 1.477 0.903 0 O-C-N 123.721 0.638 . . . . 71.23 110.477 175.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.527 HG21 HG21 ' A' ' 14' ' ' ILE . 53.6 t -57.68 -41.07 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 O-C-N 124.516 1.135 . . . . 61.3 111.467 -174.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.17 -43.23 98.86 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 123.704 0.628 . . . . 70.33 110.053 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -66.88 -22.55 72.16 Favored Glycine 0 CA--C 1.537 1.43 0 O-C-N 123.448 0.468 . . . . 72.13 113.442 176.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 34' ' ' ARG . 39.4 mt -84.35 -44.78 13.44 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 122.833 0.453 . . . . 53.24 110.983 178.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.612 HG21 ' HA3' ' A' ' 11' ' ' GLY . 13.3 pt -85.17 -25.06 6.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 CA-C-O 118.964 -0.541 . . . . 65.24 111.989 -172.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -54.41 -56.01 31.24 Favored Pre-proline 0 CA--C 1.571 1.787 0 C-N-CA 123.598 0.759 . . . . 72.23 112.336 -176.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.44 ' HG3' ' HG3' ' A' ' 126' ' ' PRO . 87.9 Cg_endo -72.28 -33.82 8.65 Favored 'Trans proline' 0 C--N 1.391 2.778 0 C-N-CA 122.025 1.817 . . . . 62.52 111.944 -175.208 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.473 HD12 HD21 ' A' ' 4' ' ' LEU . 4.4 mm? -65.37 -39.5 92.38 Favored 'General case' 0 C--N 1.352 0.685 0 O-C-N 123.934 0.771 . . . . 75.01 109.497 176.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.481 ' HG2' HD12 ' A' ' 8' ' ' ILE . 3.7 mm-40 -64.4 -39.92 94.79 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.107 0.963 . . . . 64.44 111.443 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 31.9 mmt -60.36 -53.52 56.59 Favored 'General case' 0 N--CA 1.475 0.807 0 O-C-N 123.658 0.599 . . . . 71.03 110.549 177.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.6 mt -71.5 -26.6 62.74 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.565 0.746 . . . . 63.41 112.187 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -46.42 26.36 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.964 0.906 . . . . 73.52 109.464 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -65.02 -34.58 78.78 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.256 0.623 . . . . 72.22 110.771 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -65.55 -45.84 81.82 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-N 115.723 -0.671 . . . . 62.41 109.647 170.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 73.58 46.79 23.71 Favored Glycine 0 C--N 1.343 0.943 0 CA-C-N 115.731 -0.668 . . . . 53.34 111.792 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -78.42 132.92 37.52 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.149 0.579 . . . . 62.41 110.205 178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 92.1 mtt180 -65.18 96.36 0.21 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.627 0.771 . . . . 74.24 110.786 -178.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.419 ' HB3' ' NE2' ' A' ' 120' ' ' GLN . 49.9 m -92.01 163.18 14.08 Favored 'General case' 0 C--O 1.239 0.539 0 CA-C-N 114.973 -1.012 . . . . 74.03 110.174 177.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 43.8 t -101.16 109.39 58.39 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 123.357 0.663 . . . . 55.05 109.375 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_exo -73.11 174.74 11.53 Favored 'Trans proline' 0 C--N 1.371 1.712 0 C-N-CA 122.71 2.273 . . . . 55.12 112.487 172.301 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB3' ' HB2' ' A' ' 58' ' ' LEU . 45.2 t -153.53 165.13 36.84 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.706 1.203 . . . . 64.4 108.091 178.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -66.45 -44.83 81.71 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.749 0.42 . . . . 73.54 110.276 -178.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 62.9 pttt -70.95 -29.16 65.09 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.835 0.854 . . . . 54.12 111.166 176.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.606 ' HB2' ' HB3' ' A' ' 55' ' ' SER . 1.7 tm? -62.17 -48.66 79.07 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 107.825 -1.176 . . . . 72.13 107.825 176.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 26.4 m -64.88 -41.31 95.73 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 114.94 -1.027 . . . . 71.22 110.587 179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 40.8 m -60.77 -44.66 96.48 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.696 0.623 . . . . 73.41 110.668 178.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.58 -43.95 97.53 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.769 0.827 . . . . 52.44 110.102 178.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' MET . . . . . . . . . . . . . 24.1 mmt -68.97 -26.11 64.88 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 123.322 0.649 . . . . 72.42 111.564 178.655 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -75.65 -39.49 57.61 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.198 0.599 . . . . 73.51 110.393 177.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -72.13 -33.29 67.67 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.53 0.732 . . . . 64.21 110.335 177.462 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -68.71 -48.01 64.93 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.293 1.037 . . . . 74.11 108.785 178.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.4 tttm -55.47 -53.29 58.12 Favored 'General case' 0 C--N 1.355 0.832 0 C-N-CA 124.592 1.157 . . . . 41.41 110.591 175.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -59.73 -43.67 94.09 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.559 0.743 . . . . 75.02 111.531 -176.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.452 ' HB1' HD12 ' A' ' 105' ' ' LEU . . . -66.65 -36.12 81.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 123.506 0.722 . . . . 62.23 111.38 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.8 mt -71.36 -33.59 69.71 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 122.875 0.47 . . . . 72.23 111.057 177.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -67.05 -34.89 78.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 122.681 0.392 . . . . 71.43 110.174 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 75' ' ' GLU . 46.8 mt-10 -64.55 -44.12 91.78 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 115.626 -0.715 . . . . 74.11 110.741 173.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 76' ' ' ILE . . . -60.91 -46.73 89.48 Favored 'General case' 0 N--CA 1.482 1.171 0 O-C-N 123.545 0.528 . . . . 74.1 110.646 176.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -56.87 -44.03 81.84 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.152 1.381 . . . . 74.33 110.22 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -65.01 -40.43 97.11 Favored Glycine 0 C--N 1.35 1.341 0 O-C-N 124.058 0.849 . . . . 73.51 113.322 178.598 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 71' ' ' GLU . 8.4 mm-40 -59.9 -60.29 4.06 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.946 0.498 . . . . 74.25 110.509 179.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.554 HG23 ' HZ ' ' A' ' 98' ' ' PHE . 1.4 pt -66.97 -20.31 26.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 112.586 0.588 . . . . 74.1 112.586 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -63.4 -48.74 76.58 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.819 -0.808 . . . . 71.44 108.819 171.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.556 ' HG2' HD21 ' A' ' 84' ' ' ASN . 35.0 ttmt -76.18 -25.38 55.16 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.693 -0.685 . . . . 75.11 111.224 -177.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.445 ' HB2' ' HA ' ' A' ' 76' ' ' ILE . 17.8 m-30 -75.35 -4.38 38.98 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.513 0.725 . . . . 33.4 112.549 178.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 88.4 p -57.43 -25.54 59.77 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.983 0.513 . . . . 65.52 111.42 173.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 31.8 m-80 -90.98 111.93 23.59 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 107.986 -1.116 . . . . 71.12 107.986 169.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.7 mpt_? -76.56 -29.74 56.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.657 0.783 . . . . 70.34 110.911 -172.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 32.7 p -69.9 -31.65 69.55 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.035 0.534 . . . . 71.34 110.642 174.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.556 HD21 ' HG2' ' A' ' 78' ' ' LYS . 41.1 t30 -62.89 -44.44 96.09 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 123.601 0.76 . . . . 71.21 110.172 174.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.625 HG21 ' SG ' ' A' ' 24' ' ' CYS . 34.5 mt -57.17 -55.06 22.76 Favored 'Isoleucine or valine' 0 C--N 1.363 1.155 0 O-C-N 124.337 1.023 . . . . 63.02 108.918 177.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' CYS . . . . . . . . . . . . . 36.5 t -53.73 -39.94 65.68 Favored 'General case' 0 N--CA 1.48 1.046 0 O-C-N 124.2 0.938 . . . . 74.22 111.866 -178.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 28.7 tpt180 -63.41 -43.77 96.54 Favored 'General case' 0 C--N 1.355 0.844 0 O-C-N 123.918 0.761 . . . . 71.13 111.585 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -78.58 -28.35 45.84 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 110.17 -0.307 . . . . 71.51 110.17 177.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.04 -26.5 43.14 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.454 1.102 . . . . 64.11 111.061 -167.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 11.1 t -76.92 -28.16 55.18 Favored 'General case' 0 CA--C 1.552 1.025 0 CA-C-N 115.882 -0.599 . . . . 74.41 110.412 173.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.01 -44.69 29.95 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.554 0.742 . . . . 64.01 110.651 178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.0 p -89.55 116.1 27.45 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.659 0.784 . . . . 73.11 109.007 177.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -96.1 -49.88 5.07 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.122 0.419 . . . . 73.23 111.563 -175.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -97.46 -43.26 7.34 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.633 -0.506 . . . . 72.14 109.633 -176.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.421 ' HE2' ' HB3' ' A' ' 99' ' ' LYS . 13.7 tmtt? -48.22 107.6 0.13 Allowed 'General case' 0 C--N 1.36 1.04 0 O-C-N 125.632 1.832 . . . . 63.34 110.325 -175.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 137' ' ' ASP . 2.5 mp -58.0 147.78 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.991 0 C-N-CA 124.112 0.965 . . . . 63.13 109.248 -177.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 6.4 tp -47.53 -42.27 22.98 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.284 1.033 . . . . 63.42 111.331 -175.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PHE . . . . . 0.554 ' HZ ' HG23 ' A' ' 76' ' ' ILE . 32.7 m-85 -120.73 32.27 6.06 Favored 'General case' 0 C--O 1.203 -1.37 0 CA-C-N 114.697 -1.138 . . . . 64.22 111.181 -179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.421 ' HB3' ' HE2' ' A' ' 95' ' ' LYS . 60.1 tttp -48.54 -63.22 1.15 Allowed 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.905 0.882 . . . . 74.54 112.792 -175.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -66.87 -48.91 67.34 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.896 0.879 . . . . 52.24 111.12 -174.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 59.9 t -61.62 -40.01 85.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-N 114.713 -1.13 . . . . 62.41 110.981 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -76.95 -28.85 55.36 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.1 0.56 . . . . 64.54 110.74 -176.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -61.88 -40.83 96.76 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 109.045 -0.724 . . . . 74.32 109.045 172.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -65.64 -48.64 71.5 Favored 'General case' 0 N--CA 1.482 1.151 0 O-C-N 123.762 0.663 . . . . 70.0 111.191 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.452 HD12 ' HB1' ' A' ' 68' ' ' ALA . 8.4 mp -55.3 -47.05 76.16 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.277 0.631 . . . . 64.35 110.534 177.317 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.505 ' O ' ' HG3' ' A' ' 110' ' ' LYS . 33.6 t -65.26 -49.89 67.86 Favored 'General case' 0 C--O 1.212 -0.917 0 O-C-N 124.347 1.03 . . . . 74.22 110.599 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -56.34 -56.38 21.79 Favored 'General case' 0 C--O 1.261 1.669 0 O-C-N 124.224 0.953 . . . . 72.45 110.734 -176.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' A' ' 112' ' ' LEU . 47.8 t -62.33 -42.04 93.95 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.185 0 CA-C-N 113.926 -1.488 . . . . 70.15 110.136 -179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TRP . . . . . 0.716 ' HH2' HG12 ' A' ' 124' ' ' VAL . 20.1 t-105 -62.94 -43.46 98.74 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 123.734 0.646 . . . . 74.12 112.289 -179.444 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LYS . . . . . 0.505 ' HG3' ' O ' ' A' ' 106' ' ' SER . 47.7 mtmt -59.52 -56.35 23.09 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.783 -0.451 . . . . 74.12 109.783 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -71.57 -21.76 61.83 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.881 -0.6 . . . . 65.21 111.862 -177.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 108' ' ' VAL . 3.3 tp -66.35 -60.0 3.17 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 107.158 -1.423 . . . . 64.53 107.158 176.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 45.8 t -52.72 -41.74 64.22 Favored 'General case' 0 C--N 1.35 0.593 0 CA-C-N 114.428 -1.26 . . . . 52.21 111.018 -179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 110' ' ' LYS . 89.8 mt -58.6 -60.39 3.89 Favored 'General case' 0 C--N 1.361 1.076 0 O-C-N 124.149 0.906 . . . . 65.1 111.346 177.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 3.5 pp -64.31 -27.76 69.25 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 120.698 0.285 . . . . 75.43 111.741 -177.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.575 ' HB3' ' HB2' ' A' ' 122' ' ' MET . 83.1 mt -67.13 -56.56 9.44 Favored 'General case' 0 C--N 1.354 0.767 0 C-N-CA 123.205 0.602 . . . . 74.55 110.389 177.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.71 -31.34 66.63 Favored 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 112.357 0.502 . . . . 63.42 112.357 -172.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 88.1 t -77.13 -57.36 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.585 0 O-C-N 123.438 0.461 . . . . 73.4 110.261 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -97.04 -57.32 2.3 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.099 0.56 . . . . 74.32 111.16 -168.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.419 ' NE2' ' HB3' ' A' ' 52' ' ' SER . 0.0 OUTLIER -74.67 -1.49 22.0 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.267 0.627 . . . . 62.12 111.37 -175.526 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 65.62 12.42 8.22 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.632 1.573 . . . . 72.45 112.182 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' MET . . . . . 0.575 ' HB2' ' HB3' ' A' ' 116' ' ' LEU . 66.8 mtp -87.01 110.96 37.18 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 124.176 0.99 . . . . 72.34 110.691 -173.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' PRO . . . . . . . . . . . . . 78.9 Cg_endo -82.43 65.79 8.22 Favored 'Trans proline' 0 C--N 1.372 1.78 0 C-N-CA 123.19 2.593 . . . . 64.42 111.4 -177.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' VAL . . . . . 0.716 HG12 ' HH2' ' A' ' 109' ' ' TRP . 37.9 t -95.77 89.33 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 115.251 -0.886 . . . . 75.44 110.595 -169.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 66.0 m -148.03 73.07 11.24 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.878 0.871 . . . . 72.1 109.281 175.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.44 ' HG3' ' HG3' ' A' ' 41' ' ' PRO . 10.0 Cg_endo -98.11 14.58 0.69 Allowed 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.326 2.684 . . . . 71.51 113.897 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.625 HG23 ' H ' ' A' ' 128' ' ' SER . 8.6 tt -141.4 -84.02 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-O 119.076 -0.488 . . . . 71.03 109.816 -174.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' SER . . . . . 0.625 ' H ' HG23 ' A' ' 127' ' ' ILE . 68.9 m -159.35 -81.04 0.05 Allowed 'General case' 0 C--O 1.241 0.629 0 N-CA-C 107.775 -1.195 . . . . 61.42 107.775 173.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . 0.443 ' HG2' ' HG2' ' A' ' 110' ' ' LYS . 26.4 tt0 179.59 -34.05 0.01 OUTLIER 'General case' 0 C--N 1.363 1.162 0 C-N-CA 124.239 1.016 . . . . 73.3 110.135 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 123.9 -9.21 8.57 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.57 -0.572 . . . . 72.51 114.089 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.89 -38.41 90.99 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.408 0.683 . . . . 74.32 111.113 176.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 14.6 m -56.85 -36.29 69.86 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 124.593 1.157 . . . . 73.43 111.454 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' TRP . . . . . 0.424 ' HA ' ' HB2' ' A' ' 136' ' ' GLU . 47.4 m0 -63.12 -27.89 69.69 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.138 0.975 . . . . 75.44 112.187 -174.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -60.35 -34.9 74.51 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 122.782 0.433 . . . . 63.22 111.544 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -89.73 -39.69 12.99 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.644 0.778 . . . . 72.12 111.135 174.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . 0.424 ' HB2' ' HA ' ' A' ' 133' ' ' TRP . 20.5 mm-40 -65.92 -64.07 0.94 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.076 0.55 . . . . 62.02 110.878 -176.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.44 ' HB3' HG21 ' A' ' 96' ' ' ILE . 3.7 m-20 -48.14 -36.56 13.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 124.554 1.142 . . . . 71.43 112.324 178.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -66.83 -58.7 4.51 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.73 0.812 . . . . 75.1 111.269 179.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.89 -39.05 87.8 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 121.445 0.641 . . . . 73.13 110.754 -177.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . 0.403 ' OD2' ' HG3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -65.81 -39.29 90.75 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 114.479 -1.237 . . . . 75.2 110.229 176.942 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -60.03 -48.9 79.81 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.648 0.379 . . . . 74.25 111.03 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.04 -54.05 51.33 Favored 'General case' 0 N--CA 1.476 0.844 0 O-C-N 124.248 0.967 . . . . 72.34 111.298 177.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -76.6 -21.96 54.86 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.33 0.863 . . . . 74.41 113.33 -172.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.482 ' HB2' ' HB3' ' A' ' 26' ' ' LYS . 32.4 t0 -86.71 -34.55 19.66 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 109.917 -0.401 . . . . 64.55 109.917 -178.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' ARG . . . . . . . . . . . . . 63.6 mtt85 -65.95 -38.19 87.95 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.043 -0.526 . . . . 72.43 109.985 168.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -64.3 -41.83 96.66 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.37 -0.832 . . . . 71.31 109.576 177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -74.28 -27.57 60.8 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.502 0.721 . . . . 74.43 111.931 179.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -77.18 -58.29 3.36 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 109.461 -0.57 . . . . 64.01 109.461 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -67.59 -44.3 78.45 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 114.655 -1.157 . . . . 74.14 111.255 -172.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 46.6 ttm -83.7 -79.3 0.21 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 109.33 -0.618 . . . . 72.15 109.33 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 61.0 tp 56.21 -74.81 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.457 1.103 . . . . 75.4 111.202 -172.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? 88.58 -25.84 0.08 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.554 1.942 . . . . 73.42 110.138 165.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -48.27 -60.28 2.78 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.393 1.477 . . . . 71.21 111.681 169.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -172.23 94.21 0.14 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.85 0.86 . . . . 65.51 108.836 -174.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 28.1 m-20 -96.95 68.4 2.31 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.029 0.932 . . . . 55.23 110.427 -172.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 . . . . . 0 C--O 1.249 1.076 0 C-N-CA 123.252 0.621 . . . . 75.4 109.737 179.369 . . . . . . . . 0 0 . 1 stop_ save_