data_6duu_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 6duu _Structure_validation_residue.Date_analyzed 2019-06-21 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 ' 3' ' ' PRO . . . . . 0.512 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 7.4 Cg_endo . . . . . 0 N--CA 1.492 1.391 0 CA-C-O 121.117 0.382 . . . . 0.0 112.216 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.4 mm -62.32 -23.87 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.527 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.0 mm -64.77 -38.45 82.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.88 0.371 . . . . 0.0 111.157 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.512 ' CG1' ' HG2' ' A' ' 3' ' ' PRO . 0.8 OUTLIER -67.43 -22.04 28.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.354 -178.762 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -57.31 -42.66 82.25 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.579 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.2 mp -60.77 -53.74 53.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.962 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.19 -40.94 94.9 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.57 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 6' ' ' ILE . . . -56.4 -45.44 80.63 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.875 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.6 -40.13 94.95 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.995 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.08 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.18 93.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.513 ' O ' HD13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -53.53 -52.77 58.6 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.712 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.428 ' N ' ' CD2' ' A' ' 14' ' ' LEU . . . -53.4 -44.63 68.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.105 0.479 . . . . 0.0 110.567 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -18.44 58.36 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.509 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -74.11 -48.2 31.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.513 HD13 ' O ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.17 -10.32 13.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.508 -178.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--N 1.327 -0.411 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.713 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.442 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 11.5 Cg_endo . . . . . 0 N--CA 1.492 1.405 0 CA-C-O 121.144 0.393 . . . . 0.0 111.739 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.425 HD12 HG23 ' A' ' 4' ' ' ILE . 5.2 mm -72.06 -22.12 21.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.431 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -65.51 -40.68 88.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.364 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.451 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -86.56 -18.2 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.949 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.98 -43.99 78.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.27 0.557 . . . . 0.0 110.069 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.582 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -56.2 -48.87 75.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.831 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.44 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.37 -41.48 73.05 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.644 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.84 73.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.179 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.15 -47.83 82.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.491 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.28 -43.61 88.06 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.99 91.95 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.463 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -59.2 -53.12 61.96 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.543 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.463 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.29 -50.13 70.32 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.491 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.04 -19.53 65.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.587 -179.73 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.41 -45.46 16.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.174 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.427 HD11 HG21 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -87.01 -20.92 7.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.407 ' N ' ' O ' ' A' ' 15' ' ' ALA . 1.4 mt . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo . . . . . 0 N--CA 1.49 1.283 0 N-CA-C 111.252 -0.326 . . . . 0.0 111.252 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.412 ' O ' HD13 ' A' ' 8' ' ' LEU . 6.0 mm -54.13 -17.63 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.192 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.2 mm -64.47 -37.84 81.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.194 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.499 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.2 mm -68.57 -28.6 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.924 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -57.3 -44.21 83.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.486 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 7.2 mp -52.39 -51.97 56.16 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.497 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -66.77 -40.38 88.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.387 -1.278 . . . . 0.0 109.22 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.94 -45.72 71.35 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.3 mt -65.91 -40.43 91.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.485 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.01 -41.47 83.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.63 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.35 66.45 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.422 ' O ' ' HB3' ' A' ' 17' ' ' LYS . 1.4 tt -81.12 -48.4 12.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.69 -43.83 72.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.009 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.485 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -70.97 -18.6 62.61 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.617 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.9 OUTLIER -64.04 -44.84 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.129 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.25 -0.14 10.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.534 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.7 mt . . . . . 0 C--O 1.233 0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.477 179.931 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.522 ' O ' ' ND2' ' A' ' 7' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.215 0 CA-C-O 121.213 0.422 . . . . 0.0 111.897 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.478 ' O ' HD12 ' A' ' 8' ' ' LEU . 9.8 mm -53.04 -30.16 16.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.848 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mt -65.51 -40.27 87.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.122 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.426 ' CG1' ' HG2' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -76.38 -27.55 17.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -178.38 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 3' ' ' PRO . 9.2 m-80 -56.78 -42.91 80.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -58.69 -46.75 86.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.478 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.425 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 26.3 mmtt -67.81 -43.57 79.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.768 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.18 -44.25 71.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.285 -0.87 . . . . 0.0 108.744 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.413 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 4.4 mt -68.62 -43.5 76.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.329 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.43 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -57.33 -43.57 83.48 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.16 -31.37 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.6 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.45 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 6.6 tt -75.11 -54.26 7.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.544 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.25 -48.73 75.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.09 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.43 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.3 -19.32 65.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.537 -178.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -69.76 -43.25 72.59 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.703 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.411 ' O ' ' HB2' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -93.07 -3.06 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.49 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 18' ' ' ILE . 5.7 mt . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.934 179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo . . . . . 0 N--CA 1.49 1.321 0 CA-C-O 121.256 0.44 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.468 ' O ' HD11 ' A' ' 8' ' ' LEU . 6.8 mm -52.87 -23.92 6.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.174 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.417 HD13 HG22 ' A' ' 5' ' ' ILE . 7.1 mm -64.99 -40.59 89.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.64 -178.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.46 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.72 -27.58 31.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.186 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -58.86 -45.04 91.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.191 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.567 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -50.34 -48.94 55.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.559 179.206 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.503 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -71.08 -41.74 70.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.232 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.99 75.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.378 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.38 -38.06 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.714 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.38 72.31 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.2 -45.59 92.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.456 ' CD2' ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -57.52 -51.29 70.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.377 178.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.456 ' N ' ' CD2' ' A' ' 14' ' ' LEU . . . -55.57 -43.25 75.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.852 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -19.63 60.19 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.657 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -69.71 -40.86 76.04 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -94.54 -6.1 10.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.477 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 C--O 1.238 0.487 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.938 -179.709 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.406 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 1.8 Cg_endo . . . . . 0 N--CA 1.49 1.289 0 CA-C-O 121.17 0.404 . . . . 0.0 111.775 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.403 HD12 HG21 ' A' ' 4' ' ' ILE . 9.2 mm -52.03 -28.4 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.162 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.3 mt -65.87 -40.31 87.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.79 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.476 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 0.8 OUTLIER -75.81 -19.46 15.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.177 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -57.12 -45.75 83.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.587 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 1.3 mp -53.78 -46.68 71.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.974 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.1 mmtt -68.39 -44.54 74.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.14 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.89 -46.13 74.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.293 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -40.88 98.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.493 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.429 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.91 -43.44 91.05 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.42 89.83 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.65 -52.9 63.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.907 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 19' ' ' LEU . . . -55.32 -44.93 76.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.661 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.481 ' HA ' ' HZ1' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.47 -19.16 64.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.541 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -78.11 -42.58 31.52 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.264 0.554 . . . . 0.0 109.636 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.48 -10.54 9.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.894 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.47 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER . . . . . 0 C--O 1.235 0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.632 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo . . . . . 0 N--CA 1.488 1.187 0 N-CA-C 110.955 -0.44 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.0 mm -52.96 -22.77 4.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.874 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.6 mt -65.04 -29.28 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.008 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.523 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 0.9 OUTLIER -82.3 -22.12 9.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.705 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -45.77 82.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.494 0.664 . . . . 0.0 109.387 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.6 mp -54.91 -52.47 62.81 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.727 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -61.85 -42.34 98.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.889 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.08 -42.8 73.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.981 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.2 tt -60.16 -48.47 81.6 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.742 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.31 91.86 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.91 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.141 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.417 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 7.3 tt -60.46 -54.98 38.97 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.05 -42.28 89.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.538 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -19.09 61.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.786 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -43.09 91.63 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.674 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.443 ' H ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -94.92 -4.81 10.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.494 -179.513 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.213 179.852 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.486 1.075 0 CA-C-O 121.343 0.476 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.0 mm -52.12 -39.62 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.809 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -64.8 -41.09 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.734 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.441 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -81.84 -25.55 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.878 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.88 -46.44 78.3 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.611 0.72 . . . . 0.0 109.168 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -50.25 -55.33 15.8 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.379 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' ALA . 11.9 mmtt -64.12 -42.97 96.64 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.791 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.77 -46.85 74.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.129 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.75 -42.76 66.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.27 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.502 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -61.04 -33.9 74.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.618 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . -56.8 -36.47 69.95 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 15' ' ' ALA . 10.0 tt -55.15 -53.94 49.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.42 ' N ' HD22 ' A' ' 14' ' ' LEU . . . -54.1 -48.85 70.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.636 -1.166 . . . . 0.0 110.665 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.53 -28.23 68.38 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.395 -0.522 . . . . 0.0 109.89 179.551 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -69.18 -49.34 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.436 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.403 ' CD1' ' HA ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -94.67 -17.55 7.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.41 -179.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.53 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.482 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.493 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 9.5 Cg_endo . . . . . 0 N--CA 1.486 1.059 0 CA-C-O 121.28 0.45 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mm -57.24 -13.46 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.807 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.443 HD13 HG22 ' A' ' 5' ' ' ILE . 6.1 mm -72.75 -39.89 60.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.834 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.524 HD11 ' N ' ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.64 -18.86 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.298 -178.784 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.13 -43.39 82.33 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.592 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -62.13 -46.37 89.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.217 178.793 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.48 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 12.4 mmtt -65.39 -41.79 93.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.36 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.65 73.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.666 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.69 -45.89 67.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.345 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.523 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.59 -44.93 90.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.731 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -44.59 90.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.428 HD21 ' C ' ' A' ' 14' ' ' LEU . 10.3 tt -59.49 -55.71 31.18 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.58 -48.8 74.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.371 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -69.72 -18.67 63.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.297 -179.191 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.76 -47.54 30.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.492 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.33 -12.4 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--N 1.327 -0.402 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.125 -179.172 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.492 1.432 0 CA-C-O 121.135 0.39 . . . . 0.0 111.571 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 4.3 mm -54.01 -25.63 13.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.654 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 mm -65.74 -33.26 62.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.445 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.51 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.4 mm -70.25 -24.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.525 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 80.5 m-20 -57.55 -43.31 84.35 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.546 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.2 mp -54.74 -51.9 64.2 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.305 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.3 mmtt -65.26 -42.82 92.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.963 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.44 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.679 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.91 -46.8 86.12 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.476 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.32 -44.69 88.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' NZ ' ' A' ' 17' ' ' LYS . . . -58.07 -35.36 71.25 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.429 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 6.9 tt -78.81 -54.9 5.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.214 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.14 93.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.779 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.476 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -57.97 -18.77 25.83 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -178.017 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.468 ' NZ ' ' O ' ' A' ' 13' ' ' ALA . 25.4 mtmm -70.35 -45.88 65.25 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.15 0.61 10.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.013 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.234 0.269 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.335 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 11.2 p90 . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 70.6 mt -119.2 106.31 43.23 Favored Pre-proline 0 C--N 1.331 -0.209 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.512 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 7.4 Cg_endo -57.92 150.18 65.35 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.055 1.837 . . . . 0.0 112.216 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.4 mm -62.32 -23.87 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.527 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.0 mm -64.77 -38.45 82.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.88 0.371 . . . . 0.0 111.157 -179.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.512 ' CG1' ' HG2' ' A' ' 3' ' ' PRO . 0.8 OUTLIER -67.43 -22.04 28.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.354 -178.762 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -57.31 -42.66 82.25 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.579 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.2 mp -60.77 -53.74 53.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.962 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.19 -40.94 94.9 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.57 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 6' ' ' ILE . . . -56.4 -45.44 80.63 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.875 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.6 -40.13 94.95 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.995 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.08 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.18 93.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.513 ' O ' HD13 ' A' ' 18' ' ' ILE . 0.7 OUTLIER -53.53 -52.77 58.6 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.712 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.428 ' N ' ' CD2' ' A' ' 14' ' ' LEU . . . -53.4 -44.63 68.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.105 0.479 . . . . 0.0 110.567 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -18.44 58.36 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.509 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -74.11 -48.2 31.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.513 HD13 ' O ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.17 -10.32 13.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.508 -178.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -153.75 95.82 1.92 Allowed 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.492 0 O-C-N 120.009 -1.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.44 ' CE2' HD21 ' A' ' 2' ' ' LEU . 6.8 p90 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.44 HD21 ' CE2' ' A' ' 1' ' ' PHE . 0.4 OUTLIER -117.48 80.75 13.34 Favored Pre-proline 0 C--O 1.234 0.249 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.442 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 11.5 Cg_endo -55.35 134.84 66.15 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.203 1.935 . . . . 0.0 111.739 -179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.425 HD12 HG23 ' A' ' 4' ' ' ILE . 5.2 mm -72.06 -22.12 21.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.431 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -65.51 -40.68 88.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.364 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.451 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -86.56 -18.2 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.949 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.98 -43.99 78.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.27 0.557 . . . . 0.0 110.069 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.582 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -56.2 -48.87 75.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.831 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.44 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.37 -41.48 73.05 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.644 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.84 73.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.179 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.15 -47.83 82.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.491 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.28 -43.61 88.06 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.99 91.95 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.463 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -59.2 -53.12 61.96 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.543 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.463 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.29 -50.13 70.32 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.491 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.04 -19.53 65.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.587 -179.73 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.41 -45.46 16.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.174 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.427 HD11 HG21 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -87.01 -20.92 7.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.407 ' N ' ' O ' ' A' ' 15' ' ' ALA . 1.4 mt -150.32 28.34 0.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -178.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.704 0 O-C-N 120.02 -1.675 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 28.0 p90 . . . . . 0 N--CA 1.487 1.398 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mt -117.43 136.04 23.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.355 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -68.03 145.36 67.25 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.443 2.095 . . . . 0.0 111.252 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.412 ' O ' HD13 ' A' ' 8' ' ' LEU . 6.0 mm -54.13 -17.63 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.192 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.2 mm -64.47 -37.84 81.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.194 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.499 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.2 mm -68.57 -28.6 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.924 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -57.3 -44.21 83.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.486 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 7.2 mp -52.39 -51.97 56.16 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.497 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -66.77 -40.38 88.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.387 -1.278 . . . . 0.0 109.22 -179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.94 -45.72 71.35 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.3 mt -65.91 -40.43 91.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.485 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.01 -41.47 83.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.63 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.35 66.45 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.422 ' O ' ' HB3' ' A' ' 17' ' ' LYS . 1.4 tt -81.12 -48.4 12.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -54.69 -43.83 72.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.009 179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -70.97 -18.6 62.61 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.617 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.9 OUTLIER -64.04 -44.84 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.129 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.25 -0.14 10.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.534 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.7 mt 59.79 42.39 16.74 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.477 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.527 0 O-C-N 120.207 -1.558 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.46 ' CD2' HD21 ' A' ' 2' ' ' LEU . 12.1 p90 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.46 HD21 ' CD2' ' A' ' 1' ' ' PHE . 28.8 mt -77.0 114.83 43.16 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.04 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.522 ' O ' ' ND2' ' A' ' 7' ' ' ASN . 1.0 OUTLIER -52.46 154.37 11.8 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.013 1.808 . . . . 0.0 111.897 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.478 ' O ' HD12 ' A' ' 8' ' ' LEU . 9.8 mm -53.04 -30.16 16.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.848 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mt -65.51 -40.27 87.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.122 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.426 ' CG1' ' HG2' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -76.38 -27.55 17.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -178.38 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 3' ' ' PRO . 9.2 m-80 -56.78 -42.91 80.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -58.69 -46.75 86.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.478 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.425 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 26.3 mmtt -67.81 -43.57 79.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.768 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.18 -44.25 71.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.285 -0.87 . . . . 0.0 108.744 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.413 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 4.4 mt -68.62 -43.5 76.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.329 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.43 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -57.33 -43.57 83.48 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.16 -31.37 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.6 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.45 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 6.6 tt -75.11 -54.26 7.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.544 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.25 -48.73 75.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.09 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.43 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.3 -19.32 65.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.537 -178.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -69.76 -43.25 72.59 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.703 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.411 ' O ' ' HB2' ' A' ' 19' ' ' LEU . 0.2 OUTLIER -93.07 -3.06 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.49 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 18' ' ' ILE . 5.7 mt 64.1 -53.28 0.26 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.934 179.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . 0.409 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.031 -1.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 48.7 p90 . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -100.03 127.65 32.93 Favored Pre-proline 0 N--CA 1.462 0.172 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -54.95 149.26 43.32 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.743 1.629 . . . . 0.0 111.766 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.468 ' O ' HD11 ' A' ' 8' ' ' LEU . 6.8 mm -52.87 -23.92 6.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.174 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.417 HD13 HG22 ' A' ' 5' ' ' ILE . 7.1 mm -64.99 -40.59 89.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.64 -178.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.46 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.72 -27.58 31.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.186 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -58.86 -45.04 91.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.191 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.567 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -50.34 -48.94 55.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.559 179.206 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.503 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -71.08 -41.74 70.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.232 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.99 75.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.378 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.38 -38.06 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.714 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.38 72.31 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.2 -45.59 92.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.456 ' CD2' ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -57.52 -51.29 70.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.377 178.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.456 ' N ' ' CD2' ' A' ' 14' ' ' LEU . . . -55.57 -43.25 75.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.852 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -74.67 -19.63 60.19 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.657 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -69.71 -40.86 76.04 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -94.54 -6.1 10.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.477 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -156.52 76.71 0.9 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.938 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.515 0 O-C-N 119.812 -1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 25.8 p90 . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.45 HD12 ' HB ' ' A' ' 6' ' ' ILE . 3.8 mm? -115.02 85.71 12.52 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.406 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 1.8 Cg_endo -51.97 155.85 7.99 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 122.115 1.877 . . . . 0.0 111.775 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.403 HD12 HG21 ' A' ' 4' ' ' ILE . 9.2 mm -52.03 -28.4 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.162 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.3 mt -65.87 -40.31 87.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.79 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.476 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 0.8 OUTLIER -75.81 -19.46 15.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.177 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -57.12 -45.75 83.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.587 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 1.3 mp -53.78 -46.68 71.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.974 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 26.1 mmtt -68.39 -44.54 74.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.14 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.89 -46.13 74.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.293 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -40.88 98.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.493 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.429 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.91 -43.44 91.05 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.42 89.83 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.65 -52.9 63.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.907 178.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.47 ' O ' ' N ' ' A' ' 19' ' ' LEU . . . -55.32 -44.93 76.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.661 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.481 ' HA ' ' HZ1' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.47 -19.16 64.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.541 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -78.11 -42.58 31.52 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.264 0.554 . . . . 0.0 109.636 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.48 -10.54 9.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.894 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.47 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -151.75 47.79 0.79 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.632 -179.562 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.577 0 O-C-N 119.917 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 40.7 p90 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -89.03 123.08 68.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.095 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -65.96 138.38 52.43 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.302 2.001 . . . . 0.0 110.955 179.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.0 mm -52.96 -22.77 4.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.874 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.6 mt -65.04 -29.28 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.008 179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.523 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 0.9 OUTLIER -82.3 -22.12 9.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.705 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -56.96 -45.77 82.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.494 0.664 . . . . 0.0 109.387 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.6 mp -54.91 -52.47 62.81 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.727 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -61.85 -42.34 98.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.889 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.08 -42.8 73.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.981 179.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.2 tt -60.16 -48.47 81.6 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.742 179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.31 91.86 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.91 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.141 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.417 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 7.3 tt -60.46 -54.98 38.97 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.05 -42.28 89.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.538 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.53 -19.09 61.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.786 -179.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -43.09 91.63 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.674 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.443 ' H ' HD12 ' A' ' 18' ' ' ILE . 0.2 OUTLIER -94.92 -4.81 10.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.494 -179.513 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.2 mt -159.07 80.45 0.77 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.213 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.679 -1.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . 0.532 ' CD1' ' CD2' ' A' ' 2' ' ' LEU . 1.6 t80 . . . . . 0 N--CA 1.484 1.267 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . 0.532 ' CD2' ' CD1' ' A' ' 1' ' ' PHE . 4.3 mm? -63.84 147.38 96.15 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.904 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -53.35 157.74 8.57 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.518 2.145 . . . . 0.0 111.65 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.0 mm -52.12 -39.62 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.809 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -64.8 -41.09 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.734 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.441 ' CD1' ' N ' ' A' ' 6' ' ' ILE . 0.0 OUTLIER -81.84 -25.55 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.878 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.88 -46.44 78.3 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.611 0.72 . . . . 0.0 109.168 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -50.25 -55.33 15.8 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.379 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' ALA . 11.9 mmtt -64.12 -42.97 96.64 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.791 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.77 -46.85 74.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.129 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.75 -42.76 66.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.27 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.502 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -61.04 -33.9 74.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.618 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . -56.8 -36.47 69.95 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.42 HD22 ' N ' ' A' ' 15' ' ' ALA . 10.0 tt -55.15 -53.94 49.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.42 ' N ' HD22 ' A' ' 14' ' ' LEU . . . -54.1 -48.85 70.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.636 -1.166 . . . . 0.0 110.665 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.53 -28.23 68.38 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.395 -0.522 . . . . 0.0 109.89 179.551 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -69.18 -49.34 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.436 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.403 ' CD1' ' HA ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -94.67 -17.55 7.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.41 -179.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -147.46 32.65 0.88 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.482 -179.11 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.681 0 O-C-N 119.984 -1.698 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 4.8 t80 . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -108.08 139.37 20.63 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.493 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 9.5 Cg_endo -56.67 140.99 91.69 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 C-N-CA 121.785 1.657 . . . . 0.0 111.36 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.1 mm -57.24 -13.46 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.807 -178.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.443 HD13 HG22 ' A' ' 5' ' ' ILE . 6.1 mm -72.75 -39.89 60.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.834 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.524 HD11 ' N ' ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.64 -18.86 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.298 -178.784 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.13 -43.39 82.33 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.592 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -62.13 -46.37 89.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.217 178.793 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.48 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 12.4 mmtt -65.39 -41.79 93.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.36 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.65 73.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.666 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.69 -45.89 67.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.345 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.523 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.59 -44.93 90.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.731 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -44.59 90.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.428 HD21 ' C ' ' A' ' 14' ' ' LEU . 10.3 tt -59.49 -55.71 31.18 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.58 -48.8 74.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.371 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.531 ' HA ' ' N ' ' A' ' 20' ' ' NH2 . 0.0 OUTLIER -69.72 -18.67 63.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.297 -179.191 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.76 -47.54 30.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.492 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -95.33 -12.4 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -151.33 -54.98 0.14 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . 0.531 ' N ' ' HA ' ' A' ' 16' ' ' LYS . . . . . . . . 0 C--N 1.298 -1.639 0 O-C-N 120.042 -1.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 39.8 p90 . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -110.34 97.86 33.23 Favored Pre-proline 0 C--O 1.233 0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.61 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -57.01 154.1 34.85 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.959 1.773 . . . . 0.0 111.571 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 4.3 mm -54.01 -25.63 13.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.654 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 mm -65.74 -33.26 62.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.445 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.51 ' N ' ' CD1' ' A' ' 6' ' ' ILE . 1.4 mm -70.25 -24.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.525 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 80.5 m-20 -57.55 -43.31 84.35 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.546 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.2 mp -54.74 -51.9 64.2 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.305 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.3 mmtt -65.26 -42.82 92.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.963 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.44 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.679 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.91 -46.8 86.12 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.476 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.32 -44.69 88.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' NZ ' ' A' ' 17' ' ' LYS . . . -58.07 -35.36 71.25 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.429 ' C ' ' CD2' ' A' ' 14' ' ' LEU . 6.9 tt -78.81 -54.9 5.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.214 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.59 -44.14 93.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.779 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -57.97 -18.77 25.83 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -178.017 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.468 ' NZ ' ' O ' ' A' ' 13' ' ' ALA . 25.4 mtmm -70.35 -45.88 65.25 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.15 0.61 10.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.013 -179.659 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -151.9 76.88 1.2 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.335 -179.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.466 0 O-C-N 119.795 -1.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' HD11 ' A' ' 6' ' ' ILE . 7.4 Cg_endo . . . . . 0 N--CA 1.492 1.391 0 CA-C-O 121.117 0.382 . . . . 0.0 112.216 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.4 mm -62.32 -23.87 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.527 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 5' ' ' ILE . 8.0 mm -64.77 -38.45 82.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.88 0.371 . . . . 0.0 111.157 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.696 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -67.43 -22.04 28.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.354 -178.762 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -57.31 -42.66 82.25 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.69 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -60.77 -53.74 53.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.962 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.19 -40.94 94.9 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.57 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 6' ' ' ILE . . . -56.4 -45.44 80.63 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.875 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.6 -40.13 94.95 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.995 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.08 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.18 93.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.871 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -53.53 -52.77 58.6 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.712 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.871 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -53.4 -44.63 68.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.105 0.479 . . . . 0.0 110.567 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -18.44 58.36 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.509 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -74.11 -48.2 31.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.514 HD13 ' O ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.17 -10.32 13.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.508 -178.694 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--N 1.327 -0.411 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.713 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 11.5 Cg_endo . . . . . 0 N--CA 1.492 1.405 0 CA-C-O 121.144 0.393 . . . . 0.0 111.739 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 8' ' ' LEU . 5.2 mm -72.06 -22.12 21.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.431 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -65.51 -40.68 88.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.364 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -86.56 -18.2 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.949 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.98 -43.99 78.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.27 0.557 . . . . 0.0 110.069 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.582 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -56.2 -48.87 75.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.831 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.471 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.37 -41.48 73.05 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.644 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.84 73.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.179 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.15 -47.83 82.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.517 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.28 -43.61 88.06 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.99 91.95 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.762 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -59.2 -53.12 61.96 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.543 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.762 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.29 -50.13 70.32 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.04 -19.53 65.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.587 -179.73 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.41 -45.46 16.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.174 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -87.01 -20.92 7.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.407 ' N ' ' O ' ' A' ' 15' ' ' ALA . 1.4 mt . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.493 ' HG2' HD11 ' A' ' 6' ' ' ILE . 19.4 Cg_endo . . . . . 0 N--CA 1.49 1.283 0 N-CA-C 111.252 -0.326 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.413 HG12 ' H ' ' A' ' 4' ' ' ILE . 6.0 mm -54.13 -17.63 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.192 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.2 mm -64.47 -37.84 81.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.194 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.701 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.2 mm -68.57 -28.6 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.924 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -57.3 -44.21 83.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 8' ' ' LEU . 7.2 mp -52.39 -51.97 56.16 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.497 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.403 ' H ' ' HG2' ' A' ' 9' ' ' LYS . 25.0 mmtt -66.77 -40.38 88.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.387 -1.278 . . . . 0.0 109.22 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.94 -45.72 71.35 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.3 mt -65.91 -40.43 91.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.497 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.01 -41.47 83.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.63 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.35 66.45 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.4 tt -81.12 -48.4 12.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.721 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -54.69 -43.83 72.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.009 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.497 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -70.97 -18.6 62.61 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.617 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.9 OUTLIER -64.04 -44.84 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.129 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.25 -0.14 10.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.534 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.7 mt . . . . . 0 C--O 1.233 0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.477 179.931 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.522 ' O ' ' ND2' ' A' ' 7' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.215 0 CA-C-O 121.213 0.422 . . . . 0.0 111.897 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.526 ' O ' HD13 ' A' ' 8' ' ' LEU . 9.8 mm -53.04 -30.16 16.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.848 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mt -65.51 -40.27 87.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.122 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.571 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -76.38 -27.55 17.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -178.38 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 3' ' ' PRO . 9.2 m-80 -56.78 -42.91 80.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -58.69 -46.75 86.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.478 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 26.3 mmtt -67.81 -43.57 79.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.768 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.18 -44.25 71.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.285 -0.87 . . . . 0.0 108.744 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 4.4 mt -68.62 -43.5 76.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.329 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.451 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -57.33 -43.57 83.48 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.16 -31.37 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.6 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.717 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.6 tt -75.11 -54.26 7.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.544 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.25 -48.73 75.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.09 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.3 -19.32 65.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.537 -178.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -69.76 -43.25 72.59 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.703 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -93.07 -3.06 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.49 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mt . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.934 179.341 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo . . . . . 0 N--CA 1.49 1.321 0 CA-C-O 121.256 0.44 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.493 ' O ' HD13 ' A' ' 8' ' ' LEU . 6.8 mm -52.87 -23.92 6.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.174 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.1 mm -64.99 -40.59 89.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.64 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.641 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.72 -27.58 31.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.186 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -58.86 -45.04 91.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.191 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.568 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -50.34 -48.94 55.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.559 179.206 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.56 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -71.08 -41.74 70.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.232 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.99 75.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.378 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.38 -38.06 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.714 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.38 72.31 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.2 -45.59 92.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.893 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -57.52 -51.29 70.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.377 178.625 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.893 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.57 -43.25 75.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.852 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.67 -19.63 60.19 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.657 179.698 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -69.71 -40.86 76.04 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -94.54 -6.1 10.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.477 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.505 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt . . . . . 0 C--O 1.238 0.487 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.938 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.492 ' HB2' HD12 ' A' ' 5' ' ' ILE . 1.8 Cg_endo . . . . . 0 N--CA 1.49 1.289 0 CA-C-O 121.17 0.404 . . . . 0.0 111.775 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 mm -52.03 -28.4 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.162 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.492 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.3 mt -65.87 -40.31 87.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.79 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -75.81 -19.46 15.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.177 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -57.12 -45.75 83.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.587 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 1.3 mp -53.78 -46.68 71.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.974 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 9' ' ' LYS . 26.1 mmtt -68.39 -44.54 74.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.14 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.89 -46.13 74.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.293 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -40.88 98.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.493 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.91 -43.44 91.05 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.42 89.83 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.686 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -56.65 -52.9 63.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.907 178.4 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.686 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -44.93 76.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.661 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.64 ' HA ' ' HZ3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.47 -19.16 64.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.541 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -78.11 -42.58 31.52 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.264 0.554 . . . . 0.0 109.636 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.48 -10.54 9.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.894 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.56 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--O 1.235 0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.632 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.614 ' HG2' HD13 ' A' ' 6' ' ' ILE . 19.2 Cg_endo . . . . . 0 N--CA 1.488 1.187 0 N-CA-C 110.955 -0.44 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.0 mm -52.96 -22.77 4.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.874 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.6 mt -65.04 -29.28 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.008 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.614 HD13 ' HG2' ' A' ' 3' ' ' PRO . 0.9 OUTLIER -82.3 -22.12 9.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.705 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.7 OUTLIER -56.96 -45.77 82.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.494 0.664 . . . . 0.0 109.387 179.363 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.6 mp -54.91 -52.47 62.81 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.727 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -61.85 -42.34 98.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.889 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 7' ' ' ASN . . . -55.08 -42.8 73.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.981 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.408 ' C ' HD23 ' A' ' 11' ' ' LEU . 9.2 tt -60.16 -48.47 81.6 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.742 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.31 91.86 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.91 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.141 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.669 HD23 ' C ' ' A' ' 14' ' ' LEU . 7.3 tt -60.46 -54.98 38.97 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.05 -42.28 89.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.538 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.416 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -72.53 -19.09 61.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.786 -179.274 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -43.09 91.63 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.674 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.524 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -94.92 -4.81 10.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.494 -179.513 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.213 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.486 1.075 0 CA-C-O 121.343 0.476 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.0 mm -52.12 -39.62 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.809 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -64.8 -41.09 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.734 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.597 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -81.84 -25.55 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.878 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.88 -46.44 78.3 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.611 0.72 . . . . 0.0 109.168 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -50.25 -55.33 15.8 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.379 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' ALA . 11.9 mmtt -64.12 -42.97 96.64 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.791 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.77 -46.85 74.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.129 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.75 -42.76 66.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.27 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.525 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -61.04 -33.9 74.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.618 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . -56.8 -36.47 69.95 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.0 tt -55.15 -53.94 49.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.424 ' HA ' ' CD1' ' A' ' 18' ' ' ILE . . . -54.1 -48.85 70.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.636 -1.166 . . . . 0.0 110.665 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.525 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.53 -28.23 68.38 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.395 -0.522 . . . . 0.0 109.89 179.551 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -69.18 -49.34 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.436 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' ' HA ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -94.67 -17.55 7.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.41 -179.476 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.53 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.482 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 9.5 Cg_endo . . . . . 0 N--CA 1.486 1.059 0 CA-C-O 121.28 0.45 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.428 ' N ' HD13 ' A' ' 4' ' ' ILE . 4.1 mm -57.24 -13.46 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.807 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 mm -72.75 -39.89 60.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.834 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.619 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.64 -18.86 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.298 -178.784 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.13 -43.39 82.33 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.592 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -62.13 -46.37 89.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.217 178.793 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 12.4 mmtt -65.39 -41.79 93.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.36 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.65 73.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.666 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.69 -45.89 67.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.345 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.545 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.59 -44.93 90.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.731 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -44.59 90.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.507 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.3 tt -59.49 -55.71 31.18 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.58 -48.8 74.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.371 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.545 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -69.72 -18.67 63.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.297 -179.191 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.76 -47.54 30.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.492 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.623 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -95.33 -12.4 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--N 1.327 -0.402 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.125 -179.172 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' HD11 ' A' ' 6' ' ' ILE . 5.2 Cg_endo . . . . . 0 N--CA 1.492 1.432 0 CA-C-O 121.135 0.39 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.42 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 4.3 mm -54.01 -25.63 13.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.654 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 mm -65.74 -33.26 62.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.445 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.746 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.4 mm -70.25 -24.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.525 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 80.5 m-20 -57.55 -43.31 84.35 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -54.74 -51.9 64.2 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.305 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 3.3 mmtt -65.26 -42.82 92.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.963 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.44 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.679 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.91 -46.8 86.12 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.492 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.32 -44.69 88.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -35.36 71.25 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.9 tt -78.81 -54.9 5.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.214 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HA ' HD11 ' A' ' 18' ' ' ILE . . . -59.59 -44.14 93.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.779 -178.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -57.97 -18.77 25.83 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -178.017 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -70.35 -45.88 65.25 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.403 HD11 ' HA ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -95.15 0.61 10.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.013 -179.659 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.447 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--O 1.234 0.269 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.335 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.675 ' CE2' HD21 ' A' ' 2' ' ' LEU . 11.2 p90 . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.675 HD21 ' CE2' ' A' ' 1' ' ' PHE . 70.6 mt -119.2 106.31 43.23 Favored Pre-proline 0 C--N 1.331 -0.209 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' HD11 ' A' ' 6' ' ' ILE . 7.4 Cg_endo -57.92 150.18 65.35 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.055 1.837 . . . . 0.0 112.216 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.4 mm -62.32 -23.87 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.527 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 5' ' ' ILE . 8.0 mm -64.77 -38.45 82.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.88 0.371 . . . . 0.0 111.157 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.696 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -67.43 -22.04 28.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.354 -178.762 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -57.31 -42.66 82.25 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.69 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -60.77 -53.74 53.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.962 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.19 -40.94 94.9 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.57 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 6' ' ' ILE . . . -56.4 -45.44 80.63 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.875 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.6 -40.13 94.95 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.995 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.08 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.18 93.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.871 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -53.53 -52.77 58.6 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.712 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.871 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -53.4 -44.63 68.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.105 0.479 . . . . 0.0 110.567 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -18.44 58.36 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.509 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -74.11 -48.2 31.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.514 HD13 ' O ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.17 -10.32 13.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.508 -178.694 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -153.75 95.82 1.92 Allowed 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.492 0 O-C-N 120.009 -1.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.752 ' CE2' HD23 ' A' ' 2' ' ' LEU . 6.8 p90 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.752 HD23 ' CE2' ' A' ' 1' ' ' PHE . 0.4 OUTLIER -117.48 80.75 13.34 Favored Pre-proline 0 C--O 1.234 0.249 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 11.5 Cg_endo -55.35 134.84 66.15 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.203 1.935 . . . . 0.0 111.739 -179.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 8' ' ' LEU . 5.2 mm -72.06 -22.12 21.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.431 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -65.51 -40.68 88.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.364 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -86.56 -18.2 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.949 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.411 ' OD1' HD12 ' A' ' 2' ' ' LEU . 8.1 m-20 -55.98 -43.99 78.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.27 0.557 . . . . 0.0 110.069 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.582 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -56.2 -48.87 75.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.831 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.471 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.37 -41.48 73.05 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.644 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.84 73.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.179 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.15 -47.83 82.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.517 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.28 -43.61 88.06 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.99 91.95 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.762 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -59.2 -53.12 61.96 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.543 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.762 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.29 -50.13 70.32 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.04 -19.53 65.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.587 -179.73 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.41 -45.46 16.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.174 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -87.01 -20.92 7.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.407 ' N ' ' O ' ' A' ' 15' ' ' ALA . 1.4 mt -150.32 28.34 0.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -178.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.704 0 O-C-N 120.02 -1.675 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 28.0 p90 . . . . . 0 N--CA 1.487 1.398 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mt -117.43 136.04 23.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.355 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.493 ' HG2' HD11 ' A' ' 6' ' ' ILE . 19.4 Cg_endo -68.03 145.36 67.25 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.443 2.095 . . . . 0.0 111.252 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.413 HG12 ' H ' ' A' ' 4' ' ' ILE . 6.0 mm -54.13 -17.63 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.192 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.2 mm -64.47 -37.84 81.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.194 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.701 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.2 mm -68.57 -28.6 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.924 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -57.3 -44.21 83.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 8' ' ' LEU . 7.2 mp -52.39 -51.97 56.16 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.497 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' H ' ' HG2' ' A' ' 9' ' ' LYS . 25.0 mmtt -66.77 -40.38 88.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.387 -1.278 . . . . 0.0 109.22 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.94 -45.72 71.35 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.3 mt -65.91 -40.43 91.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.497 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.01 -41.47 83.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.63 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.35 66.45 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.4 tt -81.12 -48.4 12.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.721 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -54.69 -43.83 72.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.009 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -70.97 -18.6 62.61 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.617 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.9 OUTLIER -64.04 -44.84 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.129 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.25 -0.14 10.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.534 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.7 mt 59.79 42.39 16.74 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.477 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.527 0 O-C-N 120.207 -1.558 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.62 ' CE2' HD21 ' A' ' 2' ' ' LEU . 12.1 p90 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.62 HD21 ' CE2' ' A' ' 1' ' ' PHE . 28.8 mt -77.0 114.83 43.16 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.04 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.522 ' O ' ' ND2' ' A' ' 7' ' ' ASN . 1.0 OUTLIER -52.46 154.37 11.8 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.013 1.808 . . . . 0.0 111.897 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.526 ' O ' HD13 ' A' ' 8' ' ' LEU . 9.8 mm -53.04 -30.16 16.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.848 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mt -65.51 -40.27 87.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.122 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.571 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -76.38 -27.55 17.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -178.38 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 3' ' ' PRO . 9.2 m-80 -56.78 -42.91 80.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -58.69 -46.75 86.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.478 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 26.3 mmtt -67.81 -43.57 79.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.768 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.18 -44.25 71.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.285 -0.87 . . . . 0.0 108.744 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 4.4 mt -68.62 -43.5 76.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.329 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.451 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -57.33 -43.57 83.48 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.16 -31.37 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.6 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.717 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.6 tt -75.11 -54.26 7.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.544 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.25 -48.73 75.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.09 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.3 -19.32 65.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.537 -178.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -69.76 -43.25 72.59 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.703 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' O ' ' N ' ' A' ' 20' ' ' NH2 . 0.2 OUTLIER -93.07 -3.06 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.49 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mt 64.1 -53.28 0.26 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.934 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . 0.473 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.031 -1.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 48.7 p90 . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 2' ' ' LEU . 4.3 mm? -100.03 127.65 32.93 Favored Pre-proline 0 N--CA 1.462 0.172 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -54.95 149.26 43.32 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.743 1.629 . . . . 0.0 111.766 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.493 ' O ' HD13 ' A' ' 8' ' ' LEU . 6.8 mm -52.87 -23.92 6.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.174 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.1 mm -64.99 -40.59 89.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.64 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.641 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.72 -27.58 31.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.186 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -58.86 -45.04 91.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.191 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.568 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -50.34 -48.94 55.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.559 179.206 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.56 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -71.08 -41.74 70.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.232 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.99 75.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.378 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.38 -38.06 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.714 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.38 72.31 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.2 -45.59 92.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.893 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -57.52 -51.29 70.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.377 178.625 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.893 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.57 -43.25 75.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.852 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.67 -19.63 60.19 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.657 179.698 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -69.71 -40.86 76.04 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -94.54 -6.1 10.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.477 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.505 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt -156.52 76.71 0.9 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.938 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.515 0 O-C-N 119.812 -1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.41 ' C ' HD22 ' A' ' 2' ' ' LEU . 25.8 p90 . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.416 HD12 ' HB ' ' A' ' 6' ' ' ILE . 3.8 mm? -115.02 85.71 12.52 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.492 ' HB2' HD12 ' A' ' 5' ' ' ILE . 1.8 Cg_endo -51.97 155.85 7.99 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 122.115 1.877 . . . . 0.0 111.775 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 mm -52.03 -28.4 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.162 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.492 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.3 mt -65.87 -40.31 87.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.79 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -75.81 -19.46 15.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.177 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -57.12 -45.75 83.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.587 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 1.3 mp -53.78 -46.68 71.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.974 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 9' ' ' LYS . 26.1 mmtt -68.39 -44.54 74.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.14 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.89 -46.13 74.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.293 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -40.88 98.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.493 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.91 -43.44 91.05 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.42 89.83 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.686 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -56.65 -52.9 63.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.907 178.4 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.686 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -44.93 76.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.661 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.64 ' HA ' ' HZ3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.47 -19.16 64.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.541 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -78.11 -42.58 31.52 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.264 0.554 . . . . 0.0 109.636 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.48 -10.54 9.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.894 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.56 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -151.75 47.79 0.79 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.632 -179.562 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.577 0 O-C-N 119.917 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 40.7 p90 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 2' ' ' LEU . 4.5 mm? -89.03 123.08 68.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.095 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.614 ' HG2' HD13 ' A' ' 6' ' ' ILE . 19.2 Cg_endo -65.96 138.38 52.43 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.302 2.001 . . . . 0.0 110.955 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.0 mm -52.96 -22.77 4.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.874 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.6 mt -65.04 -29.28 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.008 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.614 HD13 ' HG2' ' A' ' 3' ' ' PRO . 0.9 OUTLIER -82.3 -22.12 9.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.705 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.7 OUTLIER -56.96 -45.77 82.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.494 0.664 . . . . 0.0 109.387 179.363 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.6 mp -54.91 -52.47 62.81 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.727 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -61.85 -42.34 98.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.889 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 7' ' ' ASN . . . -55.08 -42.8 73.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.981 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.408 ' C ' HD23 ' A' ' 11' ' ' LEU . 9.2 tt -60.16 -48.47 81.6 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.742 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.31 91.86 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.91 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.141 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.669 HD23 ' C ' ' A' ' 14' ' ' LEU . 7.3 tt -60.46 -54.98 38.97 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.05 -42.28 89.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.538 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -72.53 -19.09 61.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.786 -179.274 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -43.09 91.63 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.674 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.524 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -94.92 -4.81 10.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.494 -179.513 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt -159.07 80.45 0.77 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.213 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.679 -1.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.532 ' CD1' ' CD2' ' A' ' 2' ' ' LEU . 1.6 t80 . . . . . 0 N--CA 1.484 1.267 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.532 ' CD2' ' CD1' ' A' ' 1' ' ' PHE . 4.3 mm? -63.84 147.38 96.15 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.904 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -53.35 157.74 8.57 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.518 2.145 . . . . 0.0 111.65 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.0 mm -52.12 -39.62 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.809 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -64.8 -41.09 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.734 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.597 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -81.84 -25.55 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.878 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.88 -46.44 78.3 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.611 0.72 . . . . 0.0 109.168 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -50.25 -55.33 15.8 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.379 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' ALA . 11.9 mmtt -64.12 -42.97 96.64 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.791 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.77 -46.85 74.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.129 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.75 -42.76 66.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.27 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.525 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -61.04 -33.9 74.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.618 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . -56.8 -36.47 69.95 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.0 tt -55.15 -53.94 49.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.424 ' HA ' ' CD1' ' A' ' 18' ' ' ILE . . . -54.1 -48.85 70.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.636 -1.166 . . . . 0.0 110.665 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.525 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.53 -28.23 68.38 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.395 -0.522 . . . . 0.0 109.89 179.551 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -69.18 -49.34 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.436 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' ' HA ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -94.67 -17.55 7.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.41 -179.476 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -147.46 32.65 0.88 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.482 -179.11 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.681 0 O-C-N 119.984 -1.698 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PHE . . . . . 0.438 ' CD1' HD23 ' A' ' 2' ' ' LEU . 4.8 t80 . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.438 HD23 ' CD1' ' A' ' 1' ' ' PHE . 3.8 mm? -108.08 139.37 20.63 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 9.5 Cg_endo -56.67 140.99 91.69 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 C-N-CA 121.785 1.657 . . . . 0.0 111.36 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.428 ' N ' HD13 ' A' ' 4' ' ' ILE . 4.1 mm -57.24 -13.46 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.807 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 mm -72.75 -39.89 60.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.834 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.619 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.64 -18.86 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.298 -178.784 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.13 -43.39 82.33 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.592 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -62.13 -46.37 89.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.217 178.793 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 12.4 mmtt -65.39 -41.79 93.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.36 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.65 73.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.666 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.69 -45.89 67.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.345 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.545 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.59 -44.93 90.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.731 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -44.59 90.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.507 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.3 tt -59.49 -55.71 31.18 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' NH2 . . . -55.58 -48.8 74.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.371 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HA ' ' N ' ' A' ' 20' ' ' NH2 . 0.0 OUTLIER -69.72 -18.67 63.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.297 -179.191 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.76 -47.54 30.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.492 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.623 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -95.33 -12.4 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -151.33 -54.98 0.14 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . 0.549 ' N ' ' HA ' ' A' ' 16' ' ' LYS . . . . . . . . 0 C--N 1.298 -1.639 0 O-C-N 120.042 -1.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 39.8 p90 . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 2' ' ' LEU . 4.2 mm? -110.34 97.86 33.23 Favored Pre-proline 0 C--O 1.233 0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.61 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' HD11 ' A' ' 6' ' ' ILE . 5.2 Cg_endo -57.01 154.1 34.85 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.959 1.773 . . . . 0.0 111.571 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.42 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 4.3 mm -54.01 -25.63 13.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.654 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 mm -65.74 -33.26 62.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.445 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.746 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.4 mm -70.25 -24.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.525 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 80.5 m-20 -57.55 -43.31 84.35 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -54.74 -51.9 64.2 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.305 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 3.3 mmtt -65.26 -42.82 92.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.963 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.44 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.679 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.91 -46.8 86.12 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.492 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.32 -44.69 88.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -35.36 71.25 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.9 tt -78.81 -54.9 5.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.214 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HA ' HD11 ' A' ' 18' ' ' ILE . . . -59.59 -44.14 93.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.779 -178.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -57.97 -18.77 25.83 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -178.017 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -70.35 -45.88 65.25 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.403 HD11 ' HA ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -95.15 0.61 10.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.013 -179.659 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.447 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -151.9 76.88 1.2 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.335 -179.381 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.466 0 O-C-N 119.795 -1.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' HD11 ' A' ' 6' ' ' ILE . 7.4 Cg_endo . . . . . 0 N--CA 1.492 1.391 0 CA-C-O 121.117 0.382 . . . . 0.0 112.216 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.4 mm -62.32 -23.87 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.527 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 5' ' ' ILE . 8.0 mm -64.77 -38.45 82.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.88 0.371 . . . . 0.0 111.157 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.696 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -67.43 -22.04 28.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.354 -178.762 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -57.31 -42.66 82.25 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.69 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -60.77 -53.74 53.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.962 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.19 -40.94 94.9 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.57 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 6' ' ' ILE . . . -56.4 -45.44 80.63 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.875 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.6 -40.13 94.95 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.995 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.08 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.18 93.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.871 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -53.53 -52.77 58.6 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.712 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.871 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -53.4 -44.63 68.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.105 0.479 . . . . 0.0 110.567 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -18.44 58.36 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.509 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -74.11 -48.2 31.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.514 HD13 ' O ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.17 -10.32 13.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.508 -178.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--N 1.327 -0.411 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.713 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 11.5 Cg_endo . . . . . 0 N--CA 1.492 1.405 0 CA-C-O 121.144 0.393 . . . . 0.0 111.739 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 8' ' ' LEU . 5.2 mm -72.06 -22.12 21.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.431 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -65.51 -40.68 88.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.364 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -86.56 -18.2 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.949 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -55.98 -43.99 78.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.27 0.557 . . . . 0.0 110.069 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.582 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -56.2 -48.87 75.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.831 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.471 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.37 -41.48 73.05 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.644 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.84 73.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.179 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.15 -47.83 82.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.517 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.28 -43.61 88.06 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.99 91.95 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.762 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -59.2 -53.12 61.96 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.762 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.29 -50.13 70.32 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.04 -19.53 65.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.587 -179.73 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.41 -45.46 16.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.174 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -87.01 -20.92 7.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.407 ' N ' ' O ' ' A' ' 15' ' ' ALA . 1.4 mt . . . . . 0 C--N 1.323 -0.584 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.493 ' HG2' HD11 ' A' ' 6' ' ' ILE . 19.4 Cg_endo . . . . . 0 N--CA 1.49 1.283 0 N-CA-C 111.252 -0.326 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.413 HG12 ' H ' ' A' ' 4' ' ' ILE . 6.0 mm -54.13 -17.63 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.192 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.2 mm -64.47 -37.84 81.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.194 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.701 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.2 mm -68.57 -28.6 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.924 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -57.3 -44.21 83.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 8' ' ' LEU . 7.2 mp -52.39 -51.97 56.16 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.497 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.403 ' H ' ' HG2' ' A' ' 9' ' ' LYS . 25.0 mmtt -66.77 -40.38 88.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.387 -1.278 . . . . 0.0 109.22 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.94 -45.72 71.35 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.3 mt -65.91 -40.43 91.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.497 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.01 -41.47 83.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.63 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.35 66.45 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.4 tt -81.12 -48.4 12.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.721 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -54.69 -43.83 72.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.009 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.497 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -70.97 -18.6 62.61 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.617 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.9 OUTLIER -64.04 -44.84 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.129 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.25 -0.14 10.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.534 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.7 mt . . . . . 0 C--O 1.233 0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.477 179.931 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.522 ' O ' ' ND2' ' A' ' 7' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.215 0 CA-C-O 121.213 0.422 . . . . 0.0 111.897 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.526 ' O ' HD13 ' A' ' 8' ' ' LEU . 9.8 mm -53.04 -30.16 16.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.848 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mt -65.51 -40.27 87.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.122 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.571 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -76.38 -27.55 17.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -178.38 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 3' ' ' PRO . 9.2 m-80 -56.78 -42.91 80.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -58.69 -46.75 86.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.478 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 26.3 mmtt -67.81 -43.57 79.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.768 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.18 -44.25 71.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.285 -0.87 . . . . 0.0 108.744 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 4.4 mt -68.62 -43.5 76.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.329 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.451 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -57.33 -43.57 83.48 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.16 -31.37 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.6 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.717 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.6 tt -75.11 -54.26 7.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.544 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.25 -48.73 75.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.09 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.3 -19.32 65.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.537 -178.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -69.76 -43.25 72.59 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.703 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -93.07 -3.06 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.49 179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mt . . . . . 0 N--CA 1.453 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.934 179.341 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo . . . . . 0 N--CA 1.49 1.321 0 CA-C-O 121.256 0.44 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.493 ' O ' HD13 ' A' ' 8' ' ' LEU . 6.8 mm -52.87 -23.92 6.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.174 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.1 mm -64.99 -40.59 89.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.64 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.641 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.72 -27.58 31.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.186 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -58.86 -45.04 91.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.191 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.568 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -50.34 -48.94 55.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.559 179.206 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.56 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -71.08 -41.74 70.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.232 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.99 75.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.378 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.38 -38.06 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.714 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.38 72.31 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.2 -45.59 92.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.893 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -57.52 -51.29 70.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.377 178.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.893 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.57 -43.25 75.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.852 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.67 -19.63 60.19 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.657 179.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -69.71 -40.86 76.04 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -94.54 -6.1 10.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.477 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.505 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt . . . . . 0 C--O 1.238 0.487 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.938 -179.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.492 ' HB2' HD12 ' A' ' 5' ' ' ILE . 1.8 Cg_endo . . . . . 0 N--CA 1.49 1.289 0 CA-C-O 121.17 0.404 . . . . 0.0 111.775 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 mm -52.03 -28.4 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.162 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.492 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.3 mt -65.87 -40.31 87.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.79 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -75.81 -19.46 15.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.177 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -57.12 -45.75 83.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.587 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 1.3 mp -53.78 -46.68 71.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.974 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 9' ' ' LYS . 26.1 mmtt -68.39 -44.54 74.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.14 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.89 -46.13 74.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.293 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -40.88 98.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.493 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.91 -43.44 91.05 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.42 89.83 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.686 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -56.65 -52.9 63.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.907 178.4 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.686 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -44.93 76.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.661 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.64 ' HA ' ' HZ3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.47 -19.16 64.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.541 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -78.11 -42.58 31.52 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.264 0.554 . . . . 0.0 109.636 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.48 -10.54 9.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.894 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.56 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER . . . . . 0 C--O 1.235 0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.632 -179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.614 ' HG2' HD13 ' A' ' 6' ' ' ILE . 19.2 Cg_endo . . . . . 0 N--CA 1.488 1.187 0 N-CA-C 110.955 -0.44 . . . . 0.0 110.955 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.0 mm -52.96 -22.77 4.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.874 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.6 mt -65.04 -29.28 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.008 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.614 HD13 ' HG2' ' A' ' 3' ' ' PRO . 0.9 OUTLIER -82.3 -22.12 9.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.705 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.7 OUTLIER -56.96 -45.77 82.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.494 0.664 . . . . 0.0 109.387 179.363 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.6 mp -54.91 -52.47 62.81 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.727 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -61.85 -42.34 98.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.889 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 7' ' ' ASN . . . -55.08 -42.8 73.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.981 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.408 ' C ' HD23 ' A' ' 11' ' ' LEU . 9.2 tt -60.16 -48.47 81.6 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.742 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.31 91.86 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.91 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.141 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.669 HD23 ' C ' ' A' ' 14' ' ' LEU . 7.3 tt -60.46 -54.98 38.97 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.05 -42.28 89.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.538 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.416 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -72.53 -19.09 61.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.786 -179.274 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -43.09 91.63 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.674 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.524 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -94.92 -4.81 10.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.494 -179.513 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.213 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.486 1.075 0 CA-C-O 121.343 0.476 . . . . 0.0 111.65 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.0 mm -52.12 -39.62 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.809 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -64.8 -41.09 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.734 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.597 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -81.84 -25.55 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.878 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.88 -46.44 78.3 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.611 0.72 . . . . 0.0 109.168 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -50.25 -55.33 15.8 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.379 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' ALA . 11.9 mmtt -64.12 -42.97 96.64 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.791 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.77 -46.85 74.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.129 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.75 -42.76 66.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.27 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.525 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -61.04 -33.9 74.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.618 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . -56.8 -36.47 69.95 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.0 tt -55.15 -53.94 49.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.424 ' HA ' ' CD1' ' A' ' 18' ' ' ILE . . . -54.1 -48.85 70.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.636 -1.166 . . . . 0.0 110.665 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.525 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.53 -28.23 68.38 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.395 -0.522 . . . . 0.0 109.89 179.551 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -69.18 -49.34 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.436 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' ' HA ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -94.67 -17.55 7.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.41 -179.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.53 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.482 -179.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 9.5 Cg_endo . . . . . 0 N--CA 1.486 1.059 0 CA-C-O 121.28 0.45 . . . . 0.0 111.36 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.428 ' N ' HD13 ' A' ' 4' ' ' ILE . 4.1 mm -57.24 -13.46 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.807 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 mm -72.75 -39.89 60.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.834 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.619 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.64 -18.86 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.298 -178.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.13 -43.39 82.33 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.592 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -62.13 -46.37 89.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.217 178.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 12.4 mmtt -65.39 -41.79 93.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.36 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.65 73.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.666 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.69 -45.89 67.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.345 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.545 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.59 -44.93 90.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.731 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -44.59 90.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.507 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.3 tt -59.49 -55.71 31.18 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -55.58 -48.8 74.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.371 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.545 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -69.72 -18.67 63.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.297 -179.191 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.76 -47.54 30.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.492 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.623 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -95.33 -12.4 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt . . . . . 0 C--N 1.327 -0.402 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.125 -179.172 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' HD11 ' A' ' 6' ' ' ILE . 5.2 Cg_endo . . . . . 0 N--CA 1.492 1.432 0 CA-C-O 121.135 0.39 . . . . 0.0 111.571 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.42 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 4.3 mm -54.01 -25.63 13.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.654 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 mm -65.74 -33.26 62.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.445 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.746 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.4 mm -70.25 -24.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.525 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 80.5 m-20 -57.55 -43.31 84.35 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -54.74 -51.9 64.2 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.305 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 3.3 mmtt -65.26 -42.82 92.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.963 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.44 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.679 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.91 -46.8 86.12 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.492 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.32 -44.69 88.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -35.36 71.25 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.9 tt -78.81 -54.9 5.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.214 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HA ' HD11 ' A' ' 18' ' ' ILE . . . -59.59 -44.14 93.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.779 -178.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -57.97 -18.77 25.83 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -178.017 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -70.35 -45.88 65.25 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.403 HD11 ' HA ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -95.15 0.61 10.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.013 -179.659 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.447 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--O 1.234 0.269 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.335 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.675 ' CE2' HD21 ' A' ' 2' ' ' LEU . 11.2 p90 . . . . . 0 N--CA 1.488 1.429 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.675 HD21 ' CE2' ' A' ' 1' ' ' PHE . 70.6 mt -119.2 106.31 43.23 Favored Pre-proline 0 C--N 1.331 -0.209 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' HD11 ' A' ' 6' ' ' ILE . 7.4 Cg_endo -57.92 150.18 65.35 Favored 'Trans proline' 0 C--N 1.31 -1.469 0 C-N-CA 122.055 1.837 . . . . 0.0 112.216 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 13.4 mm -62.32 -23.87 33.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.527 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.403 ' H ' HG12 ' A' ' 5' ' ' ILE . 8.0 mm -64.77 -38.45 82.75 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.88 0.371 . . . . 0.0 111.157 -179.038 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.696 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -67.43 -22.04 28.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.354 -178.762 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -57.31 -42.66 82.25 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.69 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -60.77 -53.74 53.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.962 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -65.19 -40.94 94.9 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.57 -179.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 6' ' ' ILE . . . -56.4 -45.44 80.63 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.875 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.6 -40.13 94.95 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.995 179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.08 179.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.47 -41.18 93.65 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 178.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.871 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -53.53 -52.77 58.6 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.228 -0.897 . . . . 0.0 110.712 179.38 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.871 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -53.4 -44.63 68.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.105 0.479 . . . . 0.0 110.567 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.85 -18.44 58.36 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.509 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.4 tmmm? -74.11 -48.2 31.19 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 -178.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.514 HD13 ' O ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.17 -10.32 13.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.487 -0.485 . . . . 0.0 111.508 -178.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.3 mt -153.75 95.82 1.92 Allowed 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.492 0 O-C-N 120.009 -1.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.752 ' CE2' HD23 ' A' ' 2' ' ' LEU . 6.8 p90 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.752 HD23 ' CE2' ' A' ' 1' ' ' PHE . 0.4 OUTLIER -117.48 80.75 13.34 Favored Pre-proline 0 C--O 1.234 0.249 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.611 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 11.5 Cg_endo -55.35 134.84 66.15 Favored 'Trans proline' 0 C--N 1.31 -1.474 0 C-N-CA 122.203 1.935 . . . . 0.0 111.739 -179.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.429 ' O ' HD13 ' A' ' 8' ' ' LEU . 5.2 mm -72.06 -22.12 21.0 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.431 -178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 14.3 mm -65.51 -40.68 88.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 C-N-CA 120.503 -0.479 . . . . 0.0 110.364 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -86.56 -18.2 8.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.949 -179.911 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.411 ' OD1' HD12 ' A' ' 2' ' ' LEU . 8.1 m-20 -55.98 -43.99 78.13 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.27 0.557 . . . . 0.0 110.069 179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.582 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -56.2 -48.87 75.54 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.831 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.471 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -70.37 -41.48 73.05 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-N 115.158 -0.928 . . . . 0.0 108.644 179.437 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.62 -44.84 73.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.179 178.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 14.1 tp -62.15 -47.83 82.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.517 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.28 -43.61 88.06 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.08 -44.99 91.95 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.762 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -59.2 -53.12 61.96 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 178.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.762 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.29 -50.13 70.32 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.546 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.04 -19.53 65.88 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.587 -179.73 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.41 -45.46 16.04 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.174 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.435 HD13 ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -87.01 -20.92 7.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.331 -179.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.407 ' N ' ' O ' ' A' ' 15' ' ' ALA . 1.4 mt -150.32 28.34 0.73 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.563 -178.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.704 0 O-C-N 120.02 -1.675 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 28.0 p90 . . . . . 0 N--CA 1.487 1.398 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 2.7 mt -117.43 136.04 23.39 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.355 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.493 ' HG2' HD11 ' A' ' 6' ' ' ILE . 19.4 Cg_endo -68.03 145.36 67.25 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 C-N-CA 122.443 2.095 . . . . 0.0 111.252 179.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.413 HG12 ' H ' ' A' ' 4' ' ' ILE . 6.0 mm -54.13 -17.63 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.192 -178.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 13.2 mm -64.47 -37.84 81.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.194 -179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.701 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.2 mm -68.57 -28.6 40.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.924 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -57.3 -44.21 83.92 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.526 ' N ' HD12 ' A' ' 8' ' ' LEU . 7.2 mp -52.39 -51.97 56.16 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.497 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.403 ' H ' ' HG2' ' A' ' 9' ' ' LYS . 25.0 mmtt -66.77 -40.38 88.18 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 114.387 -1.278 . . . . 0.0 109.22 -179.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.94 -45.72 71.35 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.3 mt -65.91 -40.43 91.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.497 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.01 -41.47 83.16 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.63 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.24 -32.35 66.45 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.4 tt -81.12 -48.4 12.19 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.164 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.721 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -54.69 -43.83 72.83 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.009 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.2 OUTLIER -70.97 -18.6 62.61 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.551 -0.46 . . . . 0.0 110.617 -179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.442 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.9 OUTLIER -64.04 -44.84 91.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.129 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -95.25 -0.14 10.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.534 179.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.7 mt 59.79 42.39 16.74 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.477 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.527 0 O-C-N 120.207 -1.558 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.62 ' CE2' HD21 ' A' ' 2' ' ' LEU . 12.1 p90 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.62 HD21 ' CE2' ' A' ' 1' ' ' PHE . 28.8 mt -77.0 114.83 43.16 Favored Pre-proline 0 C--N 1.326 -0.429 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.04 179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.522 ' O ' ' ND2' ' A' ' 7' ' ' ASN . 1.0 OUTLIER -52.46 154.37 11.8 Favored 'Trans proline' 0 N--CA 1.489 1.215 0 C-N-CA 122.013 1.808 . . . . 0.0 111.897 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.526 ' O ' HD13 ' A' ' 8' ' ' LEU . 9.8 mm -53.04 -30.16 16.03 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.848 -178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 mt -65.51 -40.27 87.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.122 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.571 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -76.38 -27.55 17.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -178.38 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.522 ' ND2' ' O ' ' A' ' 3' ' ' PRO . 9.2 m-80 -56.78 -42.91 80.27 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-O 121.27 0.557 . . . . 0.0 109.578 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.599 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -58.69 -46.75 86.57 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.549 -0.75 . . . . 0.0 109.478 179.473 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.447 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 26.3 mmtt -67.81 -43.57 79.36 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.768 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.18 -44.25 71.39 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.285 -0.87 . . . . 0.0 108.744 178.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.424 ' O ' ' HB3' ' A' ' 14' ' ' LEU . 4.4 mt -68.62 -43.5 76.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.329 178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.451 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -57.33 -43.57 83.48 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.16 -31.37 70.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.6 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.717 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.6 tt -75.11 -54.26 7.45 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.544 179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -56.25 -48.73 75.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.09 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.451 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.3 -19.32 65.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.537 -178.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.9 tmmm? -69.76 -43.25 72.59 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.703 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' O ' ' N ' ' A' ' 20' ' ' NH2 . 0.2 OUTLIER -93.07 -3.06 10.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.49 179.731 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.7 mt 64.1 -53.28 0.26 Allowed 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.934 179.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . 0.473 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.031 -1.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 48.7 p90 . . . . . 0 N--CA 1.488 1.453 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 2' ' ' LEU . 4.3 mm? -100.03 127.65 32.93 Favored Pre-proline 0 N--CA 1.462 0.172 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -54.95 149.26 43.32 Favored 'Trans proline' 0 C--N 1.307 -1.644 0 C-N-CA 121.743 1.629 . . . . 0.0 111.766 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.493 ' O ' HD13 ' A' ' 8' ' ' LEU . 6.8 mm -52.87 -23.92 6.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 115.569 -0.742 . . . . 0.0 111.174 -179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.1 mm -64.99 -40.59 89.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.64 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.641 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.72 -27.58 31.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.186 -178.599 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -58.86 -45.04 91.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.191 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.568 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -50.34 -48.94 55.29 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.534 0.683 . . . . 0.0 109.559 179.206 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.56 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -71.08 -41.74 70.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.232 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.13 -45.99 75.6 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.378 178.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mp -60.38 -38.06 82.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.714 179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.38 72.31 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.2 -45.59 92.64 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.893 HD23 ' N ' ' A' ' 15' ' ' ALA . 0.3 OUTLIER -57.52 -51.29 70.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.377 178.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.893 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.57 -43.25 75.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.852 179.442 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -74.67 -19.63 60.19 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.657 179.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.6 tmmm? -69.71 -40.86 76.04 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -94.54 -6.1 10.28 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.477 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.505 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt -156.52 76.71 0.9 Allowed 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.938 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.515 0 O-C-N 119.812 -1.805 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.41 ' C ' HD22 ' A' ' 2' ' ' LEU . 25.8 p90 . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.416 HD12 ' HB ' ' A' ' 6' ' ' ILE . 3.8 mm? -115.02 85.71 12.52 Favored Pre-proline 0 C--N 1.33 -0.245 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.492 ' HB2' HD12 ' A' ' 5' ' ' ILE . 1.8 Cg_endo -51.97 155.85 7.99 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 C-N-CA 122.115 1.877 . . . . 0.0 111.775 179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 9.2 mm -52.03 -28.4 10.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.162 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.492 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.3 mt -65.87 -40.31 87.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 120.606 -0.438 . . . . 0.0 110.79 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.8 OUTLIER -75.81 -19.46 15.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.177 -179.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -57.12 -45.75 83.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.587 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 1.3 mp -53.78 -46.68 71.07 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.849 -1.069 . . . . 0.0 108.974 178.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.444 ' HG2' ' H ' ' A' ' 9' ' ' LYS . 26.1 mmtt -68.39 -44.54 74.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.498 -1.228 . . . . 0.0 109.14 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.89 -46.13 74.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.293 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.52 -40.88 98.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.493 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.44 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.91 -43.44 91.05 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.168 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.22 -46.42 89.83 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.686 HD23 ' N ' ' A' ' 15' ' ' ALA . 1.0 OUTLIER -56.65 -52.9 63.13 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 115.255 -0.884 . . . . 0.0 108.907 178.4 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.686 ' N ' HD23 ' A' ' 14' ' ' LEU . . . -55.32 -44.93 76.3 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.661 179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.64 ' HA ' ' HZ3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.47 -19.16 64.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.165 179.541 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.8 ttmm -78.11 -42.58 31.52 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.264 0.554 . . . . 0.0 109.636 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -94.48 -10.54 9.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.565 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.894 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.56 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.8 OUTLIER -151.75 47.79 0.79 Allowed 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.632 -179.562 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.577 0 O-C-N 119.917 -1.74 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 40.7 p90 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.447 HD13 ' HA ' ' A' ' 2' ' ' LEU . 4.5 mm? -89.03 123.08 68.23 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 120.984 -0.286 . . . . 0.0 111.095 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.614 ' HG2' HD13 ' A' ' 6' ' ' ILE . 19.2 Cg_endo -65.96 138.38 52.43 Favored 'Trans proline' 0 C--N 1.311 -1.431 0 C-N-CA 122.302 2.001 . . . . 0.0 110.955 179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 10.0 mm -52.96 -22.77 4.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.874 -179.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.524 HD12 ' HB2' ' A' ' 3' ' ' PRO . 2.6 mt -65.04 -29.28 46.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.008 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.614 HD13 ' HG2' ' A' ' 3' ' ' PRO . 0.9 OUTLIER -82.3 -22.12 9.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.705 -179.617 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 10' ' ' ALA . 0.7 OUTLIER -56.96 -45.77 82.63 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.494 0.664 . . . . 0.0 109.387 179.363 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.457 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 5.6 mp -54.91 -52.47 62.81 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.896 -1.047 . . . . 0.0 109.727 179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt -61.85 -42.34 98.93 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 114.516 -1.22 . . . . 0.0 108.889 179.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.431 ' HB3' ' O ' ' A' ' 7' ' ' ASN . . . -55.08 -42.8 73.29 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.722 -1.127 . . . . 0.0 109.981 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.408 ' C ' HD23 ' A' ' 11' ' ' LEU . 9.2 tt -60.16 -48.47 81.6 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.742 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.23 -43.31 91.86 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -36.99 76.91 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.463 -0.79 . . . . 0.0 109.141 179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.669 HD23 ' C ' ' A' ' 14' ' ' LEU . 7.3 tt -60.46 -54.98 38.97 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.05 -42.28 89.9 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.538 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' NZ ' ' O ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -72.53 -19.09 61.58 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.786 -179.274 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -43.09 91.63 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.208 -0.597 . . . . 0.0 109.674 -179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.524 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -94.92 -4.81 10.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.494 -179.513 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 1.2 mt -159.07 80.45 0.77 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.213 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.37 0 O-C-N 119.679 -1.888 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.532 ' CD1' ' CD2' ' A' ' 2' ' ' LEU . 1.6 t80 . . . . . 0 N--CA 1.484 1.267 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.532 ' CD2' ' CD1' ' A' ' 1' ' ' PHE . 4.3 mm? -63.84 147.38 96.15 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.904 -179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -53.35 157.74 8.57 Favored 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 122.518 2.145 . . . . 0.0 111.65 178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 12.0 mm -52.12 -39.62 27.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.809 -178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.7 mt -64.8 -41.09 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 C-N-CA 120.366 -0.534 . . . . 0.0 110.734 -179.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.597 ' N ' HD13 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -81.84 -25.55 9.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 C-N-CA 120.801 -0.36 . . . . 0.0 110.878 179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.88 -46.44 78.3 Favored 'General case' 0 CA--C 1.507 -0.709 0 CA-C-O 121.611 0.72 . . . . 0.0 109.168 179.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 3.8 mp -50.25 -55.33 15.8 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.379 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.461 ' O ' ' N ' ' A' ' 13' ' ' ALA . 11.9 mmtt -64.12 -42.97 96.64 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.791 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.77 -46.85 74.43 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.232 -0.894 . . . . 0.0 109.129 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 59.0 mt -71.75 -42.76 66.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.424 -0.807 . . . . 0.0 109.27 178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.525 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -61.04 -33.9 74.02 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.618 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.461 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . -56.8 -36.47 69.95 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.442 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.0 tt -55.15 -53.94 49.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.424 ' HA ' ' CD1' ' A' ' 18' ' ' ILE . . . -54.1 -48.85 70.26 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.636 -1.166 . . . . 0.0 110.665 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.525 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -66.53 -28.23 68.38 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.395 -0.522 . . . . 0.0 109.89 179.551 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 5.2 tmmm? -69.18 -49.34 57.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.436 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.424 ' CD1' ' HA ' ' A' ' 15' ' ' ALA . 0.2 OUTLIER -94.67 -17.55 7.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 120.375 -0.53 . . . . 0.0 111.41 -179.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' A' ' 15' ' ' ALA . 0.7 OUTLIER -147.46 32.65 0.88 Allowed 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.768 -0.373 . . . . 0.0 110.482 -179.11 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.297 -1.681 0 O-C-N 119.984 -1.698 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . 0.438 ' CD1' HD23 ' A' ' 2' ' ' LEU . 4.8 t80 . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.438 HD23 ' CD1' ' A' ' 1' ' ' PHE . 3.8 mm? -108.08 139.37 20.63 Favored Pre-proline 0 C--N 1.32 -0.697 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' ' CG1' ' A' ' 6' ' ' ILE . 9.5 Cg_endo -56.67 140.99 91.69 Favored 'Trans proline' 0 C--N 1.308 -1.604 0 C-N-CA 121.785 1.657 . . . . 0.0 111.36 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.428 ' N ' HD13 ' A' ' 4' ' ' ILE . 4.1 mm -57.24 -13.46 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.807 -178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 6.1 mm -72.75 -39.89 60.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.834 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.619 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.0 OUTLIER -70.64 -18.86 21.35 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.298 -178.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -57.13 -43.39 82.33 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.592 ' N ' ' CD1' ' A' ' 8' ' ' LEU . 0.5 OUTLIER -62.13 -46.37 89.33 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.217 178.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.507 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 12.4 mmtt -65.39 -41.79 93.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.925 -1.034 . . . . 0.0 109.36 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.64 -46.65 73.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.666 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.1 mp -69.69 -45.89 67.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.345 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.545 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.59 -44.93 90.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.731 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.81 -44.59 90.87 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.507 HD23 ' C ' ' A' ' 14' ' ' LEU . 10.3 tt -59.49 -55.71 31.18 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.489 ' O ' ' N ' ' A' ' 20' ' ' NH2 . . . -55.58 -48.8 74.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.144 -0.934 . . . . 0.0 111.371 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.549 ' HA ' ' N ' ' A' ' 20' ' ' NH2 . 0.0 OUTLIER -69.72 -18.67 63.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.297 -179.191 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -74.76 -47.54 30.54 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.492 -179.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.623 HD13 ' H ' ' A' ' 18' ' ' ILE . 0.2 OUTLIER -95.33 -12.4 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.0 mt -151.33 -54.98 0.14 Allowed 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.52 -0.472 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . 0.549 ' N ' ' HA ' ' A' ' 16' ' ' LYS . . . . . . . . 0 C--N 1.298 -1.639 0 O-C-N 120.042 -1.661 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PHE . . . . . . . . . . . . . 39.8 p90 . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 2' ' ' LEU . 4.2 mm? -110.34 97.86 33.23 Favored Pre-proline 0 C--O 1.233 0.201 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.61 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HG2' HD11 ' A' ' 6' ' ' ILE . 5.2 Cg_endo -57.01 154.1 34.85 Favored 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 121.959 1.773 . . . . 0.0 111.571 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.42 ' O ' ' HB2' ' A' ' 7' ' ' ASN . 4.3 mm -54.01 -25.63 13.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.654 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 11.1 mm -65.74 -33.26 62.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.445 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.746 ' N ' HD13 ' A' ' 6' ' ' ILE . 1.4 mm -70.25 -24.03 25.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.525 -179.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 4' ' ' ILE . 80.5 m-20 -57.55 -43.31 84.35 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.579 ' N ' HD12 ' A' ' 8' ' ' LEU . 5.2 mp -54.74 -51.9 64.2 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.305 179.249 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.432 ' HE2' ' HB2' ' A' ' 8' ' ' LEU . 3.3 mmtt -65.26 -42.82 92.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.556 -1.202 . . . . 0.0 108.963 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.44 82.41 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.679 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.91 -46.8 86.12 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 178.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.492 ' O ' ' HD2' ' A' ' 16' ' ' LYS . . . -58.32 -44.69 88.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.526 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.07 -35.36 71.25 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.662 HD23 ' C ' ' A' ' 14' ' ' LEU . 6.9 tt -78.81 -54.9 5.6 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.214 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.403 ' HA ' HD11 ' A' ' 18' ' ' ILE . . . -59.59 -44.14 93.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.779 -178.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.492 ' HD2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -57.97 -18.77 25.83 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.522 0.564 . . . . 0.0 112.522 -178.017 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -70.35 -45.88 65.25 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.403 HD11 ' HA ' ' A' ' 15' ' ' ALA . 0.1 OUTLIER -95.15 0.61 10.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.013 -179.659 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.447 ' O ' ' NZ ' ' A' ' 16' ' ' LYS . 0.5 OUTLIER -151.9 76.88 1.2 Allowed 'General case' 0 C--O 1.234 0.269 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.335 -179.381 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.466 0 O-C-N 119.795 -1.816 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_