data_2lco_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lco _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 10' ' ' LEU . . . . . 0.437 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 122.169 0.985 . . . . 0.0 108.863 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.0 -17.79 0.06 Allowed 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.481 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.437 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.7 mt -70.73 -63.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -37.46 74.93 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.98 -48.51 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.82 -25.59 63.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tt -73.49 -67.37 0.59 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -75.07 -42.58 56.57 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -51.69 -53.31 40.44 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.46 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.129 179.82 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.43 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 122.142 0.973 . . . . 0.0 108.797 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.87 -17.68 0.05 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.571 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' ' C ' ' A' ' 10' ' ' LEU . 11.3 mt -70.3 -63.48 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.936 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.03 76.05 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.6 -48.57 69.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.66 -25.39 62.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.79 -67.19 0.62 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.287 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -74.99 -42.46 57.49 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -51.56 -53.33 39.09 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.584 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.281 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.186 179.833 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.449 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 122.246 1.022 . . . . 0.0 108.632 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.67 -17.84 0.05 Allowed 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.484 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.449 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.5 mt -70.91 -64.45 0.9 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -36.08 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.39 -47.75 69.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.6 63.46 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 tp -73.74 -67.43 0.6 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.664 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -75.14 -42.27 56.56 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.62 -53.28 40.26 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.046 -0.661 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.202 179.823 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.228 -0.041 0 CA-C-O 122.13 0.967 . . . . 0.0 108.917 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.63 -28.63 3.62 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.354 -1.294 . . . . 0.0 110.938 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.67 -63.98 0.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.597 -0.441 . . . . 0.0 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.83 70.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.51 -48.35 72.0 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.31 -25.63 59.63 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tt -72.81 -68.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.501 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -75.09 -41.65 58.29 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -51.59 -53.31 39.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.557 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.397 179.891 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.439 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 122.389 1.09 . . . . 0.0 108.608 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.6 -17.63 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.619 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.527 ' N ' ' CD1' ' A' ' 12' ' ' LEU . 6.9 mp -71.88 -65.11 0.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -34.94 69.54 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.62 -48.55 66.26 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.05 -25.56 61.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.29 -68.0 0.53 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.441 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -75.1 -41.63 58.29 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -51.58 -53.21 40.59 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.557 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.441 179.989 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 pt? . . . . . 0 CA--C 1.511 -0.529 0 CA-C-O 121.989 0.9 . . . . 0.0 109.912 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.56 -31.88 3.06 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 113.761 -1.563 . . . . 0.0 110.275 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 17.7 tp -70.62 -55.37 8.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.77 -36.74 74.9 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.86 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.37 -25.63 59.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tt -72.52 -68.14 0.5 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.371 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -75.17 -41.49 57.99 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.5 t90 -51.63 -53.23 40.84 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.523 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.126 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.443 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 122.193 0.996 . . . . 0.0 109.045 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.65 -17.58 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.568 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' C ' ' A' ' 10' ' ' LEU . 14.8 tp -71.35 -64.89 0.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.77 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.97 -48.02 67.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.57 -25.59 62.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -73.87 -67.23 0.62 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.649 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -75.1 -42.34 56.78 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -51.51 -53.14 40.7 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.45 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.117 179.859 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.523 -0.07 0 CA-C-O 121.991 0.901 . . . . 0.0 108.844 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.63 -30.42 8.89 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.966 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.85 -62.93 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.76 72.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.84 -48.16 73.22 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.29 -25.68 62.11 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.98 -67.29 0.58 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.311 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.3 p-90 -75.14 -42.33 56.46 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 24.7 t90 -51.61 -53.17 41.24 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.48 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.101 179.885 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.442 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 122.208 1.004 . . . . 0.0 109.003 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.53 -17.56 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.665 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.442 ' N ' ' C ' ' A' ' 10' ' ' LEU . 1.7 tt -71.17 -64.99 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.4 -35.94 70.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.33 -47.47 66.03 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 -25.55 63.52 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -73.94 -67.27 0.62 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.661 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 50.6 p-90 -75.18 -42.29 56.1 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -51.37 -53.12 39.58 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.385 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.126 179.921 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.437 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 122.206 1.003 . . . . 0.0 108.94 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.95 -17.69 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.68 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.527 ' N ' ' CD1' ' A' ' 12' ' ' LEU . 6.9 mp -70.81 -64.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.19 -37.15 74.22 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.81 -48.15 73.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.74 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -74.02 -66.88 0.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.522 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -75.13 -42.77 55.55 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.58 -53.28 39.9 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.136 -0.625 . . . . 0.0 109.398 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.11 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.067 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.505 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.7 -133.43 1.53 Allowed Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.607 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.72 9.91 0.78 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.794 -0.703 . . . . 0.0 109.181 179.635 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.505 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.5 -57.24 3.79 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.257 0.551 . . . . 0.0 109.584 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.5 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.3 mp -53.15 -27.65 22.24 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.261 -0.882 . . . . 0.0 108.7 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.65 -9.65 0.08 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.582 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.5 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.4 mt -87.81 -25.39 23.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.175 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.52 -55.5 44.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.69 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_exo -41.12 -51.12 4.02 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.367 2.045 . . . . 0.0 112.395 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.66 -25.45 67.96 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.166 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.437 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -89.1 -11.83 42.86 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 122.169 0.985 . . . . 0.0 108.863 -179.914 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.0 -17.79 0.06 Allowed 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.481 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.437 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.7 mt -70.73 -63.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -37.46 74.93 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.98 -48.51 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.82 -25.59 63.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tt -73.49 -67.37 0.59 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -75.07 -42.58 56.57 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -51.69 -53.31 40.44 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.46 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.11 30.14 2.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.129 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.157 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.511 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.37 -133.65 1.56 Allowed Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.601 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.89 10.61 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 114.773 -0.714 . . . . 0.0 109.298 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.511 ' H ' ' C ' ' A' ' 1' ' ' GLY . 8.0 m95 -80.24 -56.73 4.0 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.248 0.547 . . . . 0.0 109.552 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 mp -53.26 -27.71 23.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -53.8 -19.43 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.939 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.7 mt -97.66 -0.75 45.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.416 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.575 ' N ' ' CD ' ' A' ' 8' ' ' PRO . . . -70.26 -36.78 6.36 Favored Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.575 ' CD ' ' N ' ' A' ' 7' ' ' ALA . 88.1 Cg_exo -51.2 -51.53 11.0 Favored 'Trans proline' 0 N--CA 1.501 1.918 0 C-N-CA 122.079 1.853 . . . . 0.0 112.119 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.58 -18.93 55.89 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.189 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.43 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -88.06 -11.48 47.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 122.142 0.973 . . . . 0.0 108.797 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.87 -17.68 0.05 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.571 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' ' C ' ' A' ' 10' ' ' LEU . 11.3 mt -70.3 -63.48 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.936 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.03 76.05 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.6 -48.57 69.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.66 -25.39 62.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tt -73.79 -67.19 0.62 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.287 -179.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -74.99 -42.46 57.49 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -51.56 -53.33 39.09 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.584 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -102.14 33.16 3.18 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.186 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.099 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.525 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.43 -133.54 1.54 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.624 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.58 9.95 0.74 Allowed 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 114.75 -0.725 . . . . 0.0 109.242 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.525 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.8 m95 -79.5 -57.11 3.85 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.33 0.586 . . . . 0.0 109.502 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.475 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.4 mp -53.23 -27.75 23.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.626 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.47 -11.14 0.11 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.649 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.475 ' H ' ' C ' ' A' ' 4' ' ' LEU . 22.6 mt -88.19 -25.9 22.68 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.307 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.479 ' O ' ' N ' ' A' ' 11' ' ' ALA . . . -58.66 -55.05 50.04 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.75 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -41.3 -51.09 4.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 122.362 2.042 . . . . 0.0 112.233 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.77 67.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.937 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.449 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -87.62 -11.7 47.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 122.246 1.022 . . . . 0.0 108.632 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 7' ' ' ALA . . . -46.67 -17.84 0.05 Allowed 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.484 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.449 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.5 mt -70.91 -64.45 0.9 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -36.08 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.39 -47.75 69.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.6 63.46 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 tp -73.74 -67.43 0.6 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.664 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -75.14 -42.27 56.56 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.62 -53.28 40.26 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.046 -0.661 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.38 28.94 2.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.202 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.106 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.502 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.64 -133.33 1.51 Allowed Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.617 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.72 9.99 0.77 Allowed 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.705 -0.748 . . . . 0.0 109.178 179.619 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.502 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.67 -57.09 3.85 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.297 0.57 . . . . 0.0 109.492 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.4 mp -53.23 -27.57 22.75 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.49 -9.68 0.08 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.559 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.0 mt -87.98 -25.58 23.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.085 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' O ' ' N ' ' A' ' 10' ' ' LEU . . . -60.05 -55.28 47.0 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.75 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -40.88 -51.04 3.86 Favored 'Trans proline' 0 N--CA 1.498 1.743 0 C-N-CA 122.362 2.041 . . . . 0.0 112.246 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.97 -24.57 67.96 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.938 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.453 ' N ' ' O ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -89.23 -11.94 42.2 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-O 122.13 0.967 . . . . 0.0 108.917 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.63 -28.63 3.62 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.354 -1.294 . . . . 0.0 110.938 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.67 -63.98 0.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.597 -0.441 . . . . 0.0 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.83 70.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.51 -48.35 72.0 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.31 -25.63 59.63 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.3 tt -72.81 -68.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.501 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -75.09 -41.65 58.29 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -51.59 -53.31 39.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.557 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ETA . . . -88.31 24.87 1.78 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.397 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . 0.422 ' CB ' ' O ' ' A' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.115 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.503 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.8 -133.39 1.52 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.589 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.75 9.93 0.78 Allowed 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 114.739 -0.73 . . . . 0.0 109.279 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.503 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.4 -57.18 3.83 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.257 0.551 . . . . 0.0 109.548 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.505 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.4 mp -53.21 -27.58 22.6 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.679 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.46 -9.66 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.394 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.505 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.0 mt -89.67 -27.13 20.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.178 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.52 ' O ' ' N ' ' A' ' 11' ' ' ALA . . . -56.77 -54.53 53.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.689 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -41.33 -51.06 4.24 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.24 1.96 . . . . 0.0 112.297 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.23 -29.05 66.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.978 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.439 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -87.7 -11.34 48.58 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 122.389 1.09 . . . . 0.0 108.608 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' A' ' 7' ' ' ALA . . . -46.6 -17.63 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.619 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.527 ' N ' ' CD1' ' A' ' 12' ' ' LEU . 6.9 mp -71.88 -65.11 0.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -34.94 69.54 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.62 -48.55 66.26 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.05 -25.56 61.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.433 ' O ' ' O ' ' A' ' 20' ' ' ETA . 1.3 tt -73.29 -68.0 0.53 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.441 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -75.1 -41.63 58.29 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -51.58 -53.21 40.59 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.557 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.458 ' O ' ' CB ' ' A' ' 20' ' ' ETA . . . -86.91 23.38 1.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.441 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . 0.458 ' CB ' ' O ' ' A' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.517 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -167.09 -133.41 1.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.603 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.75 10.06 0.76 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.738 -0.731 . . . . 0.0 109.261 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.517 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.6 -57.4 3.7 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 121.262 0.553 . . . . 0.0 109.581 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.45 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.3 mp -53.15 -27.47 21.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.69 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.42 -11.28 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.68 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.45 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.6 mt -84.94 -25.11 28.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.178 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -60.77 -56.83 31.23 Favored Pre-proline 0 CA--C 1.54 0.596 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.653 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.409 ' C ' ' H ' ' A' ' 10' ' ' LEU . 18.3 Cg_exo -38.36 -39.58 1.08 Allowed 'Trans proline' 0 N--CA 1.499 1.82 0 C-N-CA 122.584 2.189 . . . . 0.0 112.524 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.19 -4.59 0.21 Allowed 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.75 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.409 ' H ' ' C ' ' A' ' 8' ' ' PRO . 1.2 pt? -76.88 -10.9 59.69 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.989 0.9 . . . . 0.0 109.912 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.56 -31.88 3.06 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 113.761 -1.563 . . . . 0.0 110.275 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 17.7 tp -70.62 -55.37 8.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.77 -36.74 74.9 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.86 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.37 -25.63 59.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 tt -72.52 -68.14 0.5 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.371 -179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -75.17 -41.49 57.99 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.5 t90 -51.63 -53.23 40.84 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.523 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.05 29.45 2.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.126 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.118 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.517 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.89 -133.46 1.53 Allowed Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.605 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.64 9.94 0.76 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.689 -0.755 . . . . 0.0 109.201 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.517 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.6 -57.31 3.74 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-O 121.306 0.574 . . . . 0.0 109.591 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.508 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.3 mp -53.07 -27.66 21.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.667 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.41 -9.88 0.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.596 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.508 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.1 mt -88.23 -25.52 22.82 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.209 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.412 ' O ' ' N ' ' A' ' 10' ' ' LEU . . . -59.88 -55.19 48.11 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 120.879 -0.329 . . . . 0.0 110.723 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -41.35 -51.1 4.25 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.404 2.069 . . . . 0.0 112.454 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.178 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.443 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -89.14 -11.46 43.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 122.193 0.996 . . . . 0.0 109.045 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.65 -17.58 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.568 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' C ' ' A' ' 10' ' ' LEU . 14.8 tp -71.35 -64.89 0.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.77 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.97 -48.02 67.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.57 -25.59 62.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -73.87 -67.23 0.62 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.649 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -75.1 -42.34 56.78 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -51.51 -53.14 40.7 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.45 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.38 28.89 2.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.117 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.068 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.522 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.84 -133.4 1.52 Allowed Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.608 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.71 10.15 0.73 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 114.766 -0.717 . . . . 0.0 109.265 179.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.522 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.78 -57.2 3.78 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 121.33 0.586 . . . . 0.0 109.534 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.502 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.3 mp -53.24 -27.46 22.38 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.55 -9.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.65 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.502 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.7 mt -87.88 -25.46 23.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.42 ' O ' ' N ' ' A' ' 10' ' ' LEU . . . -61.0 -55.34 45.58 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.695 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -41.11 -51.05 4.04 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.338 2.025 . . . . 0.0 112.213 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -22.66 65.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.94 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.42 ' N ' ' O ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -89.18 -12.1 41.89 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-O 121.991 0.901 . . . . 0.0 108.844 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.63 -30.42 8.89 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.966 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 3.2 tt -68.85 -62.93 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.76 72.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.84 -48.16 73.22 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.29 -25.68 62.11 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tt -72.98 -67.29 0.58 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.311 -179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.3 p-90 -75.14 -42.33 56.46 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 24.7 t90 -51.61 -53.17 41.24 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.48 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.07 30.61 2.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.101 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.507 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.74 -133.26 1.5 Allowed Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.599 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.71 9.94 0.77 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.732 -0.734 . . . . 0.0 109.193 179.612 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.507 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.58 -57.15 3.82 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 121.339 0.59 . . . . 0.0 109.515 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' A' ' 6' ' ' LEU . 1.4 mp -53.26 -27.53 22.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.61 -9.32 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.422 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.512 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.8 mt -88.95 -25.73 21.9 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.174 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.404 ' O ' ' N ' ' A' ' 10' ' ' LEU . . . -58.7 -55.02 50.32 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.608 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -41.26 -51.07 4.17 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.372 2.048 . . . . 0.0 112.535 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.35 67.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.122 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.442 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.3 OUTLIER -89.17 -11.22 44.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 122.208 1.004 . . . . 0.0 109.003 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.53 -17.56 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.665 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.442 ' N ' ' C ' ' A' ' 10' ' ' LEU . 1.7 tt -71.17 -64.99 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.4 -35.94 70.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.33 -47.47 66.03 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 -25.55 63.52 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -73.94 -67.27 0.62 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.661 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.42 ' O ' ' O ' ' A' ' 20' ' ' ETA . 50.6 p-90 -75.18 -42.29 56.1 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -51.37 -53.12 39.58 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.385 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.73 28.53 1.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.126 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . 0.42 ' O ' ' O ' ' A' ' 17' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.229 0.014 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.504 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.45 -133.63 1.55 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' TRP . . . . . 0.608 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.84 10.48 0.69 Allowed 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 114.727 -0.737 . . . . 0.0 109.26 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . 0.504 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -80.2 -56.56 4.13 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.4 mp -53.43 -27.57 25.33 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -53.87 -19.88 5.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.92 179.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.5 mt -97.7 -0.24 45.84 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.395 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' N ' ' CD ' ' A' ' 8' ' ' PRO . . . -70.86 -36.48 5.27 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 7' ' ' ALA . 84.1 Cg_exo -49.42 -51.36 10.84 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.173 1.916 . . . . 0.0 112.223 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.72 -26.3 68.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.886 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.437 ' C ' ' N ' ' A' ' 12' ' ' LEU . 0.4 OUTLIER -89.36 -11.91 41.92 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-O 122.206 1.003 . . . . 0.0 108.94 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.95 -17.69 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.68 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.527 ' N ' ' CD1' ' A' ' 12' ' ' LEU . 6.9 mp -70.81 -64.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.19 -37.15 74.22 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.81 -48.15 73.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.74 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -74.02 -66.88 0.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.522 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -75.13 -42.77 55.55 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.58 -53.28 39.9 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.136 -0.625 . . . . 0.0 109.398 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.82 29.38 2.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 122.169 0.985 . . . . 0.0 108.863 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.0 -17.79 0.06 Allowed 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.481 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.437 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.7 mt -70.73 -63.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -37.46 74.93 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.98 -48.51 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.82 -25.59 63.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -73.49 -67.37 0.59 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -75.07 -42.58 56.57 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -51.69 -53.31 40.44 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.46 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.129 179.82 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 122.142 0.973 . . . . 0.0 108.797 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.87 -17.68 0.05 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.571 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' ' C ' ' A' ' 10' ' ' LEU . 11.3 mt -70.3 -63.48 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.936 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.03 76.05 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.6 -48.57 69.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.66 -25.39 62.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.79 -67.19 0.62 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.287 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -74.99 -42.46 57.49 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -51.56 -53.33 39.09 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.584 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.281 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.186 179.833 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.585 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 122.246 1.022 . . . . 0.0 108.632 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.67 -17.84 0.05 Allowed 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.484 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.449 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.5 mt -70.91 -64.45 0.9 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -36.08 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.39 -47.75 69.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.6 63.46 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 tp -73.74 -67.43 0.6 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.664 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -75.14 -42.27 56.56 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.62 -53.28 40.26 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.046 -0.661 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.202 179.823 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.228 -0.041 0 CA-C-O 122.13 0.967 . . . . 0.0 108.917 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.63 -28.63 3.62 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.354 -1.294 . . . . 0.0 110.938 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.67 -63.98 0.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.597 -0.441 . . . . 0.0 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.83 70.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.51 -48.35 72.0 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -57.31 -25.63 59.63 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.448 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -72.81 -68.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.501 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -75.09 -41.65 58.29 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -51.59 -53.31 39.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.557 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.397 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.584 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 122.389 1.09 . . . . 0.0 108.608 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.6 -17.63 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.619 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -71.88 -65.11 0.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -34.94 69.54 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.62 -48.55 66.26 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.409 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -58.05 -25.56 61.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.29 -68.0 0.53 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.441 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -75.1 -41.63 58.29 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -51.58 -53.21 40.59 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.557 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.441 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 pt? . . . . . 0 CA--C 1.511 -0.529 0 CA-C-O 121.989 0.9 . . . . 0.0 109.912 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.56 -31.88 3.06 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 113.761 -1.563 . . . . 0.0 110.275 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 17.7 tp -70.62 -55.37 8.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.77 -36.74 74.9 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.86 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.37 -25.63 59.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.2 tt -72.52 -68.14 0.5 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.371 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -75.17 -41.49 57.99 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.5 t90 -51.63 -53.23 40.84 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.523 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.126 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 122.193 0.996 . . . . 0.0 109.045 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.65 -17.58 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.568 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' C ' ' A' ' 10' ' ' LEU . 14.8 tp -71.35 -64.89 0.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.77 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.97 -48.02 67.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.57 -25.59 62.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -73.87 -67.23 0.62 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.649 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -75.1 -42.34 56.78 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -51.51 -53.14 40.7 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.45 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.117 179.859 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.523 -0.07 0 CA-C-O 121.991 0.901 . . . . 0.0 108.844 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.63 -30.42 8.89 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.966 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.459 ' C ' HD23 ' A' ' 12' ' ' LEU . 3.2 tt -68.85 -62.93 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.76 72.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.84 -48.16 73.22 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.29 -25.68 62.11 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -72.98 -67.29 0.58 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.311 -179.6 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.3 p-90 -75.14 -42.33 56.46 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 24.7 t90 -51.61 -53.17 41.24 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.48 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.101 179.885 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 122.208 1.004 . . . . 0.0 109.003 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.53 -17.56 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.665 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.465 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.7 tt -71.17 -64.99 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.4 -35.94 70.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.33 -47.47 66.03 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 -25.55 63.52 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -73.94 -67.27 0.62 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.661 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 50.6 p-90 -75.18 -42.29 56.1 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -51.37 -53.12 39.58 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.385 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.126 179.921 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 122.206 1.003 . . . . 0.0 108.94 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.95 -17.69 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.68 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -70.81 -64.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.19 -37.15 74.22 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.81 -48.15 73.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.74 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -74.02 -66.88 0.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.522 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -75.13 -42.77 55.55 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.58 -53.28 39.9 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.136 -0.625 . . . . 0.0 109.398 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.11 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.619 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.23 0.067 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.474 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.7 -133.43 1.53 Allowed Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.607 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.72 9.91 0.78 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.794 -0.703 . . . . 0.0 109.181 179.635 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.474 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.5 -57.24 3.79 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.257 0.551 . . . . 0.0 109.584 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.619 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.15 -27.65 22.24 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.261 -0.882 . . . . 0.0 108.7 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.65 -9.65 0.08 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.582 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.4 mt -87.81 -25.39 23.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.175 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.642 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -60.52 -55.5 44.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 56.1 Cg_exo -41.12 -51.12 4.02 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.367 2.045 . . . . 0.0 112.395 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.66 -25.45 67.96 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.166 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -89.1 -11.83 42.86 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 122.169 0.985 . . . . 0.0 108.863 -179.914 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.0 -17.79 0.06 Allowed 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.481 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.437 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.7 mt -70.73 -63.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -37.46 74.93 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.98 -48.51 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.82 -25.59 63.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -73.49 -67.37 0.59 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -75.07 -42.58 56.57 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -51.69 -53.31 40.44 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.46 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.11 30.14 2.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.129 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.644 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.232 0.157 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.479 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.37 -133.65 1.56 Allowed Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.601 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.89 10.61 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 114.773 -0.714 . . . . 0.0 109.298 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.479 ' H ' ' C ' ' A' ' 1' ' ' GLY . 8.0 m95 -80.24 -56.73 4.0 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.248 0.547 . . . . 0.0 109.552 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.644 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.26 -27.71 23.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -53.8 -19.43 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.939 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.7 mt -97.66 -0.75 45.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.416 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.575 ' N ' ' CD ' ' A' ' 8' ' ' PRO . . . -70.26 -36.78 6.36 Favored Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.575 ' CD ' ' N ' ' A' ' 7' ' ' ALA . 88.1 Cg_exo -51.2 -51.53 11.0 Favored 'Trans proline' 0 N--CA 1.501 1.918 0 C-N-CA 122.079 1.853 . . . . 0.0 112.119 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.58 -18.93 55.89 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.189 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -88.06 -11.48 47.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 122.142 0.973 . . . . 0.0 108.797 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.87 -17.68 0.05 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.571 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' ' C ' ' A' ' 10' ' ' LEU . 11.3 mt -70.3 -63.48 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.936 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.03 76.05 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.6 -48.57 69.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.66 -25.39 62.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.79 -67.19 0.62 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.287 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -74.99 -42.46 57.49 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -51.56 -53.33 39.09 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.584 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -102.14 33.16 3.18 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.186 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.645 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.099 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.489 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.43 -133.54 1.54 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.624 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.58 9.95 0.74 Allowed 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 114.75 -0.725 . . . . 0.0 109.242 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.489 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.8 m95 -79.5 -57.11 3.85 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.33 0.586 . . . . 0.0 109.502 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.645 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.23 -27.75 23.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.626 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.47 -11.14 0.11 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.649 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 4' ' ' LEU . 22.6 mt -88.19 -25.9 22.68 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.307 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.648 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -58.66 -55.05 50.04 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.75 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 53.7 Cg_exo -41.3 -51.09 4.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 122.362 2.042 . . . . 0.0 112.233 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.77 67.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.937 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.585 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -87.62 -11.7 47.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 122.246 1.022 . . . . 0.0 108.632 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 7' ' ' ALA . . . -46.67 -17.84 0.05 Allowed 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.484 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.449 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.5 mt -70.91 -64.45 0.9 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -36.08 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.39 -47.75 69.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.6 63.46 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 tp -73.74 -67.43 0.6 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.664 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -75.14 -42.27 56.56 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.62 -53.28 40.26 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.046 -0.661 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.38 28.94 2.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.202 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.626 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.106 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.484 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.64 -133.33 1.51 Allowed Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.617 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.72 9.99 0.77 Allowed 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.705 -0.748 . . . . 0.0 109.178 179.619 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.484 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.67 -57.09 3.85 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.297 0.57 . . . . 0.0 109.492 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.626 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.23 -27.57 22.75 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.49 -9.68 0.08 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.559 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.467 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.0 mt -87.98 -25.58 23.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.085 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.641 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -60.05 -55.28 47.0 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.75 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 50.3 Cg_exo -40.88 -51.04 3.86 Favored 'Trans proline' 0 N--CA 1.498 1.743 0 C-N-CA 122.362 2.041 . . . . 0.0 112.246 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.97 -24.57 67.96 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.938 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -89.23 -11.94 42.2 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-O 122.13 0.967 . . . . 0.0 108.917 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.63 -28.63 3.62 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.354 -1.294 . . . . 0.0 110.938 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.67 -63.98 0.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.597 -0.441 . . . . 0.0 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.83 70.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.51 -48.35 72.0 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -57.31 -25.63 59.63 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.448 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -72.81 -68.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.501 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -75.09 -41.65 58.29 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -51.59 -53.31 39.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.557 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ETA . . . -88.31 24.87 1.78 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.397 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ETA . . . . . 0.422 ' CB ' ' O ' ' A' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.637 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.115 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.48 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.8 -133.39 1.52 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.589 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.75 9.93 0.78 Allowed 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 114.739 -0.73 . . . . 0.0 109.279 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.48 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.4 -57.18 3.83 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.257 0.551 . . . . 0.0 109.548 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.637 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.21 -27.58 22.6 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.679 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.46 -9.66 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.394 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.488 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.0 mt -89.67 -27.13 20.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.178 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.638 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -56.77 -54.53 53.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.689 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.638 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 50.6 Cg_exo -41.33 -51.06 4.24 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.24 1.96 . . . . 0.0 112.297 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.23 -29.05 66.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.978 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.584 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -87.7 -11.34 48.58 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 122.389 1.09 . . . . 0.0 108.608 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' A' ' 7' ' ' ALA . . . -46.6 -17.63 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.619 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -71.88 -65.11 0.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -34.94 69.54 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.62 -48.55 66.26 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.409 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -58.05 -25.56 61.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.29 -68.0 0.53 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.441 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -75.1 -41.63 58.29 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -51.58 -53.21 40.59 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.557 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.458 ' O ' ' CB ' ' A' ' 20' ' ' ETA . . . -86.91 23.38 1.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.441 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ETA . . . . . 0.458 ' CB ' ' O ' ' A' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.64 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -167.09 -133.41 1.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.603 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.75 10.06 0.76 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.738 -0.731 . . . . 0.0 109.261 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.491 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.6 -57.4 3.7 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 121.262 0.553 . . . . 0.0 109.581 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.64 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.15 -27.47 21.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.69 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.42 -11.28 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.68 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.426 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.6 mt -84.94 -25.11 28.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.178 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.632 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -60.77 -56.83 31.23 Favored Pre-proline 0 CA--C 1.54 0.596 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.653 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.632 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 18.3 Cg_exo -38.36 -39.58 1.08 Allowed 'Trans proline' 0 N--CA 1.499 1.82 0 C-N-CA 122.584 2.189 . . . . 0.0 112.524 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.19 -4.59 0.21 Allowed 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.75 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.491 HD22 ' O ' ' A' ' 7' ' ' ALA . 1.2 pt? -76.88 -10.9 59.69 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.989 0.9 . . . . 0.0 109.912 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.56 -31.88 3.06 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 113.761 -1.563 . . . . 0.0 110.275 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 17.7 tp -70.62 -55.37 8.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.77 -36.74 74.9 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.86 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.37 -25.63 59.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.2 tt -72.52 -68.14 0.5 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.371 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -75.17 -41.49 57.99 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.5 t90 -51.63 -53.23 40.84 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.523 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.05 29.45 2.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.126 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.634 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.118 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.475 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.89 -133.46 1.53 Allowed Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.605 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.64 9.94 0.76 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.689 -0.755 . . . . 0.0 109.201 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.475 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.6 -57.31 3.74 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-O 121.306 0.574 . . . . 0.0 109.591 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.634 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.07 -27.66 21.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.667 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.41 -9.88 0.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.596 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.1 mt -88.23 -25.52 22.82 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.209 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.64 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -59.88 -55.19 48.11 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 120.879 -0.329 . . . . 0.0 110.723 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 55.4 Cg_exo -41.35 -51.1 4.25 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.404 2.069 . . . . 0.0 112.454 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.178 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -89.14 -11.46 43.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 122.193 0.996 . . . . 0.0 109.045 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.65 -17.58 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.568 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' C ' ' A' ' 10' ' ' LEU . 14.8 tp -71.35 -64.89 0.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.77 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.97 -48.02 67.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.57 -25.59 62.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -73.87 -67.23 0.62 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.649 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -75.1 -42.34 56.78 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -51.51 -53.14 40.7 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.45 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.38 28.89 2.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.117 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.622 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.23 0.068 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.484 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.84 -133.4 1.52 Allowed Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.608 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.71 10.15 0.73 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 114.766 -0.717 . . . . 0.0 109.265 179.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.484 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.78 -57.2 3.78 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 121.33 0.586 . . . . 0.0 109.534 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.622 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.24 -27.46 22.38 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.55 -9.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.65 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.7 mt -87.88 -25.46 23.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -61.0 -55.34 45.58 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.695 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.618 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 53.2 Cg_exo -41.11 -51.05 4.04 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.338 2.025 . . . . 0.0 112.213 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -22.66 65.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.94 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -89.18 -12.1 41.89 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-O 121.991 0.901 . . . . 0.0 108.844 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.63 -30.42 8.89 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.966 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.459 ' C ' HD23 ' A' ' 12' ' ' LEU . 3.2 tt -68.85 -62.93 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.76 72.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.84 -48.16 73.22 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.29 -25.68 62.11 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -72.98 -67.29 0.58 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.311 -179.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.3 p-90 -75.14 -42.33 56.46 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 24.7 t90 -51.61 -53.17 41.24 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.48 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.07 30.61 2.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.101 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.647 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.232 0.146 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.74 -133.26 1.5 Allowed Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.599 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.71 9.94 0.77 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.732 -0.734 . . . . 0.0 109.193 179.612 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.481 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.58 -57.15 3.82 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 121.339 0.59 . . . . 0.0 109.515 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.647 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.26 -27.53 22.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.61 -9.32 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.422 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.492 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.8 mt -88.95 -25.73 21.9 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.174 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.641 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -58.7 -55.02 50.32 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.608 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 52.6 Cg_exo -41.26 -51.07 4.17 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.372 2.048 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.35 67.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.122 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -89.17 -11.22 44.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 122.208 1.004 . . . . 0.0 109.003 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.53 -17.56 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.665 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.465 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.7 tt -71.17 -64.99 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.4 -35.94 70.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.33 -47.47 66.03 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 -25.55 63.52 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -73.94 -67.27 0.62 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.661 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 50.6 p-90 -75.18 -42.29 56.1 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -51.37 -53.12 39.58 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.385 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.73 28.53 1.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.126 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 0' ' ' ACE . . . . . 0.641 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.229 0.014 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.45 -133.63 1.55 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' TRP . . . . . 0.608 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.84 10.48 0.69 Allowed 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 114.727 -0.737 . . . . 0.0 109.26 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TRP . . . . . 0.481 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -80.2 -56.56 4.13 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.641 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.43 -27.57 25.33 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -53.87 -19.88 5.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.92 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.5 mt -97.7 -0.24 45.84 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.395 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' N ' ' CD ' ' A' ' 8' ' ' PRO . . . -70.86 -36.48 5.27 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 7' ' ' ALA . 84.1 Cg_exo -49.42 -51.36 10.84 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.173 1.916 . . . . 0.0 112.223 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.72 -26.3 68.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.886 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -89.36 -11.91 41.92 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-O 122.206 1.003 . . . . 0.0 108.94 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.95 -17.69 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.68 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -70.81 -64.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.19 -37.15 74.22 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.81 -48.15 73.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.74 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -74.02 -66.88 0.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.522 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -75.13 -42.77 55.55 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.58 -53.28 39.9 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.136 -0.625 . . . . 0.0 109.398 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.82 29.38 2.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 CA-C-O 122.169 0.985 . . . . 0.0 108.863 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.0 -17.79 0.06 Allowed 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.481 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.437 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.7 mt -70.73 -63.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -37.46 74.93 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.98 -48.51 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.82 -25.59 63.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -73.49 -67.37 0.59 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -75.07 -42.58 56.57 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -51.69 -53.31 40.44 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.46 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.129 179.82 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 122.142 0.973 . . . . 0.0 108.797 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.87 -17.68 0.05 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.571 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' ' C ' ' A' ' 10' ' ' LEU . 11.3 mt -70.3 -63.48 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.936 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.03 76.05 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.6 -48.57 69.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.66 -25.39 62.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.79 -67.19 0.62 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.287 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -74.99 -42.46 57.49 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -51.56 -53.33 39.09 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.584 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.281 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.186 179.833 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.585 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 122.246 1.022 . . . . 0.0 108.632 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.67 -17.84 0.05 Allowed 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.484 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.449 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.5 mt -70.91 -64.45 0.9 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -36.08 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.39 -47.75 69.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.6 63.46 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 tp -73.74 -67.43 0.6 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.664 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -75.14 -42.27 56.56 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.62 -53.28 40.26 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.046 -0.661 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.202 179.823 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.228 -0.041 0 CA-C-O 122.13 0.967 . . . . 0.0 108.917 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.63 -28.63 3.62 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.354 -1.294 . . . . 0.0 110.938 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.67 -63.98 0.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.597 -0.441 . . . . 0.0 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.83 70.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.51 -48.35 72.0 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -57.31 -25.63 59.63 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.448 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -72.81 -68.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.501 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -75.09 -41.65 58.29 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -51.59 -53.31 39.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.557 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.397 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.584 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.147 0 CA-C-O 122.389 1.09 . . . . 0.0 108.608 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.6 -17.63 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.619 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -71.88 -65.11 0.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -34.94 69.54 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.62 -48.55 66.26 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.409 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -58.05 -25.56 61.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.29 -68.0 0.53 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.441 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -75.1 -41.63 58.29 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -51.58 -53.21 40.59 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.557 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.409 ' HB3' ' O ' ' A' ' 15' ' ' ALA . . . . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.441 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 pt? . . . . . 0 CA--C 1.511 -0.529 0 CA-C-O 121.989 0.9 . . . . 0.0 109.912 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.56 -31.88 3.06 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 113.761 -1.563 . . . . 0.0 110.275 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 17.7 tp -70.62 -55.37 8.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.77 -36.74 74.9 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.86 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.37 -25.63 59.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.2 tt -72.52 -68.14 0.5 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.371 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -75.17 -41.49 57.99 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.5 t90 -51.63 -53.23 40.84 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.523 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.194 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.126 179.858 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.124 0 CA-C-O 122.193 0.996 . . . . 0.0 109.045 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.65 -17.58 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.568 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' C ' ' A' ' 10' ' ' LEU . 14.8 tp -71.35 -64.89 0.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.77 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.97 -48.02 67.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.57 -25.59 62.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -73.87 -67.23 0.62 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.649 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -75.1 -42.34 56.78 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -51.51 -53.14 40.7 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.45 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.117 179.859 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER . . . . . 0 CA--C 1.523 -0.07 0 CA-C-O 121.991 0.901 . . . . 0.0 108.844 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.63 -30.42 8.89 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.966 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.459 ' C ' HD23 ' A' ' 12' ' ' LEU . 3.2 tt -68.85 -62.93 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.76 72.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.84 -48.16 73.22 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.29 -25.68 62.11 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -72.98 -67.29 0.58 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.311 -179.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.3 p-90 -75.14 -42.33 56.46 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 24.7 t90 -51.61 -53.17 41.24 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.48 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.101 179.885 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.138 0 CA-C-O 122.208 1.004 . . . . 0.0 109.003 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.53 -17.56 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.665 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.465 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.7 tt -71.17 -64.99 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.4 -35.94 70.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.33 -47.47 66.03 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 -25.55 63.52 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -73.94 -67.27 0.62 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.661 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 50.6 p-90 -75.18 -42.29 56.1 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -51.37 -53.12 39.58 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.385 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.126 179.921 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.107 0 CA-C-O 122.206 1.003 . . . . 0.0 108.94 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.95 -17.69 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.68 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -70.81 -64.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.19 -37.15 74.22 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.81 -48.15 73.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.74 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -74.02 -66.88 0.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.522 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -75.13 -42.77 55.55 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.58 -53.28 39.9 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.136 -0.625 . . . . 0.0 109.398 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.11 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.619 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.23 0.067 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.474 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.7 -133.43 1.53 Allowed Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.607 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.72 9.91 0.78 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.794 -0.703 . . . . 0.0 109.181 179.635 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.474 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.5 -57.24 3.79 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.257 0.551 . . . . 0.0 109.584 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.619 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.15 -27.65 22.24 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.261 -0.882 . . . . 0.0 108.7 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.65 -9.65 0.08 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.582 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.464 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.4 mt -87.81 -25.39 23.38 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.175 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.642 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -60.52 -55.5 44.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 120.957 -0.297 . . . . 0.0 110.69 -179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 56.1 Cg_exo -41.12 -51.12 4.02 Favored 'Trans proline' 0 N--CA 1.497 1.711 0 C-N-CA 122.367 2.045 . . . . 0.0 112.395 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.66 -25.45 67.96 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.166 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.593 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -89.1 -11.83 42.86 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 122.169 0.985 . . . . 0.0 108.863 -179.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.0 -17.79 0.06 Allowed 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 114.287 -1.324 . . . . 0.0 110.481 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.437 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.7 mt -70.73 -63.63 1.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -37.46 74.93 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.98 -48.51 70.28 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.82 -25.59 63.34 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.453 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -73.49 -67.37 0.59 Allowed 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.372 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 65.7 p-90 -75.07 -42.58 56.57 Favored 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 20.2 t90 -51.69 -53.31 40.44 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.46 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -96.11 30.14 2.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.129 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.644 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.232 0.157 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.479 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.37 -133.65 1.56 Allowed Glycine 0 N--CA 1.447 -0.608 0 N-CA-C 110.326 -1.11 . . . . 0.0 110.326 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.601 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.89 10.61 0.67 Allowed 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 114.773 -0.714 . . . . 0.0 109.298 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.479 ' H ' ' C ' ' A' ' 1' ' ' GLY . 8.0 m95 -80.24 -56.73 4.0 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.248 0.547 . . . . 0.0 109.552 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.644 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.26 -27.71 23.88 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -53.8 -19.43 4.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.939 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.7 mt -97.66 -0.75 45.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.416 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.575 ' N ' ' CD ' ' A' ' 8' ' ' PRO . . . -70.26 -36.78 6.36 Favored Pre-proline 0 CA--C 1.538 0.505 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.575 ' CD ' ' N ' ' A' ' 7' ' ' ALA . 88.1 Cg_exo -51.2 -51.53 11.0 Favored 'Trans proline' 0 N--CA 1.501 1.918 0 C-N-CA 122.079 1.853 . . . . 0.0 112.119 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.58 -18.93 55.89 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.441 -0.8 . . . . 0.0 111.189 -179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.599 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -88.06 -11.48 47.03 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 122.142 0.973 . . . . 0.0 108.797 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.87 -17.68 0.05 Allowed 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.291 -1.322 . . . . 0.0 110.571 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.43 ' N ' ' C ' ' A' ' 10' ' ' LEU . 11.3 mt -70.3 -63.48 1.08 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.264 -0.425 . . . . 0.0 109.936 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.24 -38.03 76.05 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.6 -48.57 69.14 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 109.052 -0.722 . . . . 0.0 109.052 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.66 -25.39 62.73 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.447 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.79 -67.19 0.62 Allowed 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.287 -179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.6 p-90 -74.99 -42.46 57.49 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 28.6 t90 -51.56 -53.33 39.09 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.132 -0.627 . . . . 0.0 109.584 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -102.14 33.16 3.18 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.186 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.645 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.099 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.489 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.43 -133.54 1.54 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.25 -1.14 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.624 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.58 9.95 0.74 Allowed 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 114.75 -0.725 . . . . 0.0 109.242 179.592 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.489 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.8 m95 -79.5 -57.11 3.85 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.33 0.586 . . . . 0.0 109.502 179.666 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.645 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.23 -27.75 23.66 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.261 -0.881 . . . . 0.0 108.626 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.47 -11.14 0.11 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.062 -0.972 . . . . 0.0 110.649 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.445 ' H ' ' C ' ' A' ' 4' ' ' LEU . 22.6 mt -88.19 -25.9 22.68 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.307 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.648 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -58.66 -55.05 50.04 Favored Pre-proline 0 CA--C 1.541 0.602 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.75 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.648 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 53.7 Cg_exo -41.3 -51.09 4.2 Favored 'Trans proline' 0 N--CA 1.497 1.679 0 C-N-CA 122.362 2.042 . . . . 0.0 112.233 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -28.77 67.5 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.937 -179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.585 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -87.62 -11.7 47.75 Favored 'General case' 0 N--CA 1.455 -0.187 0 CA-C-O 122.246 1.022 . . . . 0.0 108.632 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 7' ' ' ALA . . . -46.67 -17.84 0.05 Allowed 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.484 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.449 ' N ' ' C ' ' A' ' 10' ' ' LEU . 12.5 mt -70.91 -64.45 0.9 Allowed 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.83 -36.08 71.79 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -53.39 -47.75 69.24 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.6 63.46 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 tp -73.74 -67.43 0.6 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.664 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 41.7 p-90 -75.14 -42.27 56.56 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 113.14 0.793 . . . . 0.0 113.14 -179.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.62 -53.28 40.26 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 120.046 -0.661 . . . . 0.0 109.518 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.38 28.94 2.07 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.202 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.626 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.106 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.484 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.64 -133.33 1.51 Allowed Glycine 0 N--CA 1.446 -0.643 0 N-CA-C 110.315 -1.114 . . . . 0.0 110.315 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.617 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.72 9.99 0.77 Allowed 'General case' 0 C--N 1.302 -1.488 0 CA-C-N 114.705 -0.748 . . . . 0.0 109.178 179.619 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.484 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.67 -57.09 3.85 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 121.297 0.57 . . . . 0.0 109.492 179.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.626 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.23 -27.57 22.75 Favored 'General case' 0 N--CA 1.447 -0.576 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.49 -9.68 0.08 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.559 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.467 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.0 mt -87.98 -25.58 23.08 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.085 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.641 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -60.05 -55.28 47.0 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.75 -179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 50.3 Cg_exo -40.88 -51.04 3.86 Favored 'Trans proline' 0 N--CA 1.498 1.743 0 C-N-CA 122.362 2.041 . . . . 0.0 112.246 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.97 -24.57 67.96 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.938 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -89.23 -11.94 42.2 Favored 'General case' 0 C--O 1.228 -0.041 0 CA-C-O 122.13 0.967 . . . . 0.0 108.917 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.63 -28.63 3.62 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 114.354 -1.294 . . . . 0.0 110.938 -179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.67 -63.98 0.97 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.597 -0.441 . . . . 0.0 109.921 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.77 -32.83 70.96 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.3 tt -54.51 -48.35 72.0 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -57.31 -25.63 59.63 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.448 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -72.81 -68.45 0.48 Allowed 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.501 -179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 39.3 p-90 -75.09 -41.65 58.29 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -51.59 -53.31 39.6 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.557 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.422 ' O ' ' CB ' ' A' ' 20' ' ' ETA . . . -88.31 24.87 1.78 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.397 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . 0.422 ' CB ' ' O ' ' A' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.637 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.115 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.48 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.8 -133.39 1.52 Allowed Glycine 0 N--CA 1.447 -0.625 0 N-CA-C 110.3 -1.12 . . . . 0.0 110.3 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.589 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.75 9.93 0.78 Allowed 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 114.739 -0.73 . . . . 0.0 109.279 179.522 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.48 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.4 -57.18 3.83 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.257 0.551 . . . . 0.0 109.548 179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.637 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.21 -27.58 22.6 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.235 -0.893 . . . . 0.0 108.679 179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.46 -9.66 0.08 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.394 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.488 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.0 mt -89.67 -27.13 20.34 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.178 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.638 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -56.77 -54.53 53.02 Favored Pre-proline 0 CA--C 1.539 0.556 0 C-N-CA 120.985 -0.286 . . . . 0.0 110.689 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.638 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 50.6 Cg_exo -41.33 -51.06 4.24 Favored 'Trans proline' 0 N--CA 1.496 1.635 0 C-N-CA 122.24 1.96 . . . . 0.0 112.297 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.23 -29.05 66.9 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.978 -179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.584 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -87.7 -11.34 48.58 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 122.389 1.09 . . . . 0.0 108.608 -179.928 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.52 ' N ' ' O ' ' A' ' 7' ' ' ALA . . . -46.6 -17.63 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.619 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.59 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -71.88 -65.11 0.81 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.47 -34.94 69.54 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.62 -48.55 66.26 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.409 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -58.05 -25.56 61.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.445 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.3 tt -73.29 -68.0 0.53 Allowed 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.441 -179.586 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 45.8 p-90 -75.1 -41.63 58.29 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 113.049 0.759 . . . . 0.0 113.049 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 16.9 t90 -51.58 -53.21 40.59 Favored 'General case' 0 C--N 1.32 -0.687 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.557 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.458 ' O ' ' CB ' ' A' ' 20' ' ' ETA . . . -86.91 23.38 1.75 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.441 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . 0.458 ' CB ' ' O ' ' A' ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.64 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -167.09 -133.41 1.53 Allowed Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 110.231 -1.148 . . . . 0.0 110.231 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.603 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.75 10.06 0.76 Allowed 'General case' 0 C--N 1.303 -1.445 0 CA-C-N 114.738 -0.731 . . . . 0.0 109.261 179.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.491 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.6 -57.4 3.7 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-O 121.262 0.553 . . . . 0.0 109.581 179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.64 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.15 -27.47 21.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.239 -0.891 . . . . 0.0 108.69 179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.4 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.42 -11.28 0.12 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.68 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.426 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.6 mt -84.94 -25.11 28.06 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.178 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.632 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -60.77 -56.83 31.23 Favored Pre-proline 0 CA--C 1.54 0.596 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.653 -179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.632 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 18.3 Cg_exo -38.36 -39.58 1.08 Allowed 'Trans proline' 0 N--CA 1.499 1.82 0 C-N-CA 122.584 2.189 . . . . 0.0 112.524 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.19 -4.59 0.21 Allowed 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.75 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.491 HD22 ' O ' ' A' ' 7' ' ' ALA . 1.2 pt? -76.88 -10.9 59.69 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 121.989 0.9 . . . . 0.0 109.912 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.56 -31.88 3.06 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 113.761 -1.563 . . . . 0.0 110.275 -179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 17.7 tp -70.62 -55.37 8.94 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.77 -36.74 74.9 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.265 -0.642 . . . . 0.0 109.265 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.0 tt -52.86 -49.52 65.62 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.37 -25.63 59.78 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.442 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.2 tt -72.52 -68.14 0.5 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.791 -0.641 . . . . 0.0 112.371 -179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 42.7 p-90 -75.17 -41.49 57.99 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 -179.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 23.5 t90 -51.63 -53.23 40.84 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.523 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.05 29.45 2.13 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.126 179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.634 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.231 0.118 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.475 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.89 -133.46 1.53 Allowed Glycine 0 N--CA 1.447 -0.624 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.605 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.64 9.94 0.76 Allowed 'General case' 0 C--N 1.302 -1.463 0 CA-C-N 114.689 -0.755 . . . . 0.0 109.201 179.588 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.475 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.6 -57.31 3.74 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-O 121.306 0.574 . . . . 0.0 109.591 179.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.634 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.07 -27.66 21.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.25 -0.887 . . . . 0.0 108.667 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.41 -9.88 0.08 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.596 179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' A' ' 4' ' ' LEU . 19.1 mt -88.23 -25.52 22.82 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.209 -179.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.64 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -59.88 -55.19 48.11 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 120.879 -0.329 . . . . 0.0 110.723 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 55.4 Cg_exo -41.35 -51.1 4.25 Favored 'Trans proline' 0 N--CA 1.497 1.713 0 C-N-CA 122.404 2.069 . . . . 0.0 112.454 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.73 -23.69 67.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.178 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.595 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -89.14 -11.46 43.84 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-O 122.193 0.996 . . . . 0.0 109.045 -179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.65 -17.58 0.05 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.394 -1.276 . . . . 0.0 110.568 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.443 ' N ' ' C ' ' A' ' 10' ' ' LEU . 14.8 tp -71.35 -64.89 0.83 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.77 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.97 -48.02 67.73 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.57 -25.59 62.71 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -73.87 -67.23 0.62 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.649 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -75.1 -42.34 56.78 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -179.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 19.5 t90 -51.51 -53.14 40.7 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.125 -0.63 . . . . 0.0 109.45 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -93.38 28.89 2.09 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.117 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.622 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.23 0.068 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.484 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.84 -133.4 1.52 Allowed Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 110.269 -1.132 . . . . 0.0 110.269 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.608 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.71 10.15 0.73 Allowed 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 114.766 -0.717 . . . . 0.0 109.265 179.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.484 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.78 -57.2 3.78 Favored 'General case' 0 C--N 1.342 0.243 0 CA-C-O 121.33 0.586 . . . . 0.0 109.534 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.622 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.3 mp -53.24 -27.46 22.38 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -51.55 -9.28 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.043 -0.981 . . . . 0.0 110.65 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.47 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.7 mt -87.88 -25.46 23.26 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.106 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.618 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -61.0 -55.34 45.58 Favored Pre-proline 0 CA--C 1.541 0.628 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.695 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.618 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 53.2 Cg_exo -41.11 -51.05 4.04 Favored 'Trans proline' 0 N--CA 1.497 1.73 0 C-N-CA 122.338 2.025 . . . . 0.0 112.213 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -22.66 65.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.94 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.2 OUTLIER -89.18 -12.1 41.89 Favored 'General case' 0 CA--C 1.523 -0.07 0 CA-C-O 121.991 0.901 . . . . 0.0 108.844 -179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.63 -30.42 8.89 Favored 'General case' 0 C--N 1.304 -1.382 0 CA-C-N 114.501 -1.227 . . . . 0.0 110.966 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.459 ' C ' HD23 ' A' ' 12' ' ' LEU . 3.2 tt -68.85 -62.93 1.17 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.39 -34.76 72.83 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 8.2 tt -54.84 -48.16 73.22 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.29 -25.68 62.11 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.462 ' C ' HD23 ' A' ' 16' ' ' LEU . 1.4 tt -72.98 -67.29 0.58 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.311 -179.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.3 p-90 -75.14 -42.33 56.46 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 24.7 t90 -51.61 -53.17 41.24 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.48 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -97.07 30.61 2.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.101 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.647 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.232 0.146 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.74 -133.26 1.5 Allowed Glycine 0 N--CA 1.446 -0.644 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.599 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.71 9.94 0.77 Allowed 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 114.732 -0.734 . . . . 0.0 109.193 179.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.481 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -79.58 -57.15 3.82 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 121.339 0.59 . . . . 0.0 109.515 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.647 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.26 -27.53 22.92 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -51.61 -9.32 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.013 -0.994 . . . . 0.0 110.422 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.492 ' H ' ' C ' ' A' ' 4' ' ' LEU . 18.8 mt -88.95 -25.73 21.9 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.174 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.641 ' HB3' ' HD3' ' A' ' 8' ' ' PRO . . . -58.7 -55.02 50.32 Favored Pre-proline 0 CA--C 1.541 0.597 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.608 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' A' ' 7' ' ' ALA . 52.6 Cg_exo -41.26 -51.07 4.17 Favored 'Trans proline' 0 N--CA 1.496 1.66 0 C-N-CA 122.372 2.048 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.45 -24.35 67.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.122 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.61 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -89.17 -11.22 44.41 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 122.208 1.004 . . . . 0.0 109.003 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.53 -17.56 0.05 OUTLIER 'General case' 0 C--N 1.306 -1.322 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.665 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.465 ' C ' HD23 ' A' ' 12' ' ' LEU . 1.7 tt -71.17 -64.99 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.4 -35.94 70.67 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -52.33 -47.47 66.03 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.91 -25.55 63.52 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -73.94 -67.27 0.62 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.661 -179.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 50.6 p-90 -75.18 -42.29 56.1 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -179.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.5 t90 -51.37 -53.12 39.58 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.385 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -91.73 28.53 1.75 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.126 179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 0' ' ' ACE . . . . . 0.641 ' H1 ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 C--O 1.229 0.014 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 3' ' ' TRP . . . -166.45 -133.63 1.55 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' TRP . . . . . 0.608 ' N ' ' CD1' ' A' ' 2' ' ' TRP . 0.0 OUTLIER -71.84 10.48 0.69 Allowed 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 114.727 -0.737 . . . . 0.0 109.26 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . 0.481 ' H ' ' C ' ' A' ' 1' ' ' GLY . 7.9 m95 -80.2 -56.56 4.13 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.641 HD11 ' H1 ' ' A' ' 0' ' ' ACE . 1.4 mp -53.43 -27.57 25.33 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.408 ' HB3' ' O ' ' A' ' 2' ' ' TRP . . . -53.87 -19.88 5.12 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.92 179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.5 mt -97.7 -0.24 45.84 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.395 -179.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' N ' ' CD ' ' A' ' 8' ' ' PRO . . . -70.86 -36.48 5.27 Favored Pre-proline 0 CA--C 1.537 0.46 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 7' ' ' ALA . 84.1 Cg_exo -49.42 -51.36 10.84 Favored 'Trans proline' 0 N--CA 1.5 1.878 0 C-N-CA 122.173 1.916 . . . . 0.0 112.223 -179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.72 -26.3 68.59 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.886 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 10' ' ' LEU . 0.4 OUTLIER -89.36 -11.91 41.92 Favored 'General case' 0 N--CA 1.457 -0.107 0 CA-C-O 122.206 1.003 . . . . 0.0 108.94 -179.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.95 -17.69 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.68 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.575 ' N ' HD12 ' A' ' 12' ' ' LEU . 6.9 mp -70.81 -64.11 0.97 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.19 -37.15 74.22 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tt -54.81 -48.15 73.14 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -58.87 -25.74 63.59 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 tp -74.02 -66.88 0.66 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.522 -179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -75.13 -42.77 55.55 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 113.188 0.81 . . . . 0.0 113.188 -179.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.8 t90 -51.58 -53.28 39.9 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 120.136 -0.625 . . . . 0.0 109.398 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -94.82 29.38 2.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ETA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_