data_6ry9_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6ry9 _Structure_validation_residue.Date_analyzed 2020-07-10 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 N-CA-C 111.99 -0.444 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -165.93 19.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.395 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 tpp85 -56.47 -28.86 60.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.435 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -147.29 146.57 29.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.311 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.06 85.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.571 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 49.04 72.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.745 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 61.3 t-105 -167.19 0.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.732 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.48 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.47 -68.67 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.856 0.36 . . . . 0.0 110.139 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -171.68 16.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.286 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 1.9 ptp180 -48.14 -87.14 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.414 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 13.7 pt -89.8 -12.48 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.497 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -53.85 -41.15 66.51 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -45.52 -16.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.054 0.454 . . . . 0.0 110.576 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.497 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -103.64 -42.15 2.04 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.513 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -105.63 -40.37 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 116.939 0.369 . . . . 0.0 111.258 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' C ' ' H ' ' A' ' 18' ' ' ILE . 81.7 tttt -59.37 -51.03 71.66 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.904 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 tp -74.98 14.86 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.095 0.474 . . . . 0.0 110.101 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.499 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.5 mt 62.11 108.44 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.517 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.07 -87.65 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.851 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.65 -20.1 79.77 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.897 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.29 -64.83 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.726 0.298 . . . . 0.0 110.628 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.25 89.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.465 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' A' ' 25' ' ' HIS . 12.6 mt -82.31 -156.44 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 53.25 9.89 0.17 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.826 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.494 ' H ' ' C ' ' A' ' 23' ' ' LEU . 89.9 m-70 -155.34 53.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.573 -179.118 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.412 ' C ' ' H ' ' A' ' 4' ' ' LYS . 32.9 ptt85 -171.86 52.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.825 0.345 . . . . 0.0 110.526 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -52.92 -13.52 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.589 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.412 ' H ' ' C ' ' A' ' 2' ' ' ARG . 11.9 ttmm -161.68 61.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.365 179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 47.3 -175.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -79.88 65.5 5.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.403 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' C ' ' H ' ' A' ' 9' ' ' ARG . 98.9 m95 -151.65 -2.27 0.31 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.98 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.434 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 1.0 OUTLIER -68.06 8.39 0.42 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.05 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' H ' ' C ' ' A' ' 7' ' ' TRP . 9.7 mmt-85 63.17 47.49 4.1 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.018 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 7.0 ptt180 -52.87 -83.38 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.425 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 17.3 tt -87.96 -16.64 8.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.35 -39.8 83.82 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.453 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -49.54 -15.53 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.114 0.483 . . . . 0.0 109.886 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.48 -44.26 2.18 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.447 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.38 -41.66 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 116.979 0.389 . . . . 0.0 111.038 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 2.9 tppp? -59.1 -38.04 78.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.507 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.5 tp -50.06 -54.88 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.966 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.493 ' O ' ' N ' ' A' ' 20' ' ' GLY . 3.2 pt -152.74 76.06 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.42 88.3 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.234 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.508 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -53.09 -16.98 4.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.635 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.2 16.23 0.48 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.946 0.403 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.508 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -157.38 -51.64 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.436 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 9.7 mp -82.4 17.73 1.64 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.96 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -166.14 40.08 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.544 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -73.0 111.51 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.515 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.5 mt . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.522 -179.965 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.981 -0.447 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -73.44 73.92 1.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.761 0.315 . . . . 0.0 110.609 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -67.26 -46.35 73.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.533 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -169.66 73.19 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.574 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 52.65 175.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.625 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -75.52 91.64 2.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.218 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.5 ' C ' ' H ' ' A' ' 9' ' ' ARG . 59.1 t90 -169.69 -6.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.343 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.58 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 2.0 pt? -63.3 2.58 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.516 -179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.572 ' NH2' ' NZ ' ' A' ' 16' ' ' LYS . 20.5 mmt180 62.69 37.36 12.79 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 120.674 0.273 . . . . 0.0 110.663 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -48.11 -92.83 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.3 pt -88.16 -8.89 10.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.88 -39.71 97.27 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.214 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -51.17 -15.4 0.35 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.68 -40.76 3.53 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.314 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.7 m -113.73 -42.85 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 116.805 0.303 . . . . 0.0 111.525 -179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.572 ' NZ ' ' NH2' ' A' ' 9' ' ' ARG . 85.2 tttt -51.17 -55.88 15.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.581 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.4 tp -77.13 39.33 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.154 0.502 . . . . 0.0 110.022 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.505 ' H ' ' C ' ' A' ' 16' ' ' LYS . 23.8 pt 34.64 56.21 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.57 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.29 173.46 51.03 Favored Glycine 0 N--CA 1.453 -0.213 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.067 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -52.14 -19.39 5.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.898 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.11 -53.34 58.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 110.467 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.26 -40.8 64.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.6 mt -80.94 57.04 2.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.69 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 26' ' ' LEU . 30.2 t70 -171.27 -21.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.547 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -76.17 37.08 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.735 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 51.06 52.34 15.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.782 0.325 . . . . 0.0 110.606 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -69.23 -13.02 62.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.493 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -142.87 -78.11 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.384 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.8 tpp85 -171.16 59.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.381 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 52.0 64.8 1.71 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.478 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 32.3 t90 -171.77 10.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.513 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.458 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.06 -92.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -166.73 25.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.298 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.575 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 20.1 ptt-85 -46.16 -60.83 2.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.531 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.575 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 1.1 pt -117.67 -13.46 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.388 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.24 -34.01 72.41 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 178.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -50.73 -18.12 0.66 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.066 0.46 . . . . 0.0 109.837 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.49 -44.66 2.47 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.277 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.4 m -103.66 -42.02 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 116.792 0.296 . . . . 0.0 111.205 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.1 tttp -61.79 -31.55 71.78 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.549 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 tt -66.93 4.11 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 120.995 0.426 . . . . 0.0 110.072 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.516 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.1 mm 62.64 88.4 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.177 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.95 -64.98 0.02 OUTLIER Glycine 0 C--N 1.331 0.266 0 C-N-CA 121.105 -0.569 . . . . 0.0 111.959 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.69 83.81 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.119 -0.562 . . . . 0.0 111.998 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.6 -55.22 27.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.772 0.32 . . . . 0.0 110.546 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.429 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -62.31 -31.46 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.516 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.37 42.93 0.36 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.332 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.429 ' H ' ' C ' ' A' ' 22' ' ' ALA . 10.9 t70 -171.9 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 51.27 88.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.523 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.429 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.031 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.264 0 N-CA-C 111.953 -0.459 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 59.6 mtt-85 56.5 70.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.611 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -76.83 -31.92 57.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -162.18 37.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.439 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 54.31 93.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.481 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 3.8 mptp? 54.12 169.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.299 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.411 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 65.2 t-105 62.59 14.02 6.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.405 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.23 -81.41 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.1 16.67 0.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.234 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' NZ ' ' A' ' 13' ' ' LYS . 2.9 ptp180 -40.46 -89.81 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.799 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -79.87 -19.22 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 110.081 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.596 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.14 -54.26 27.07 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.313 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.479 ' NZ ' ' O ' ' A' ' 10' ' ' ARG . 19.0 pttm -43.53 -19.01 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.338 -0.507 . . . . 0.0 110.432 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -92.6 -39.91 5.16 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.423 ' N ' ' O ' ' A' ' 12' ' ' GLY . 15.4 m -112.93 -47.53 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.596 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.3 tttt -56.18 -37.61 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.443 ' CG2' ' O ' ' A' ' 13' ' ' LYS . 8.0 tt -51.73 -7.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.88 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.546 ' H ' ' C ' ' A' ' 16' ' ' LYS . 7.6 mt 70.15 66.95 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.006 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.21 129.22 8.9 Favored Glycine 0 C--N 1.332 0.308 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.952 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.461 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -74.44 -2.33 63.21 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.183 -0.532 . . . . 0.0 111.901 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.59 16.84 0.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.709 0.29 . . . . 0.0 110.577 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.461 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -168.1 -47.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.503 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.491 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 8.1 mp -78.76 51.11 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -164.17 -42.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -73.7 -20.53 60.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.448 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.83 33.87 0.22 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.328 . . . . 0.0 110.553 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -76.19 -18.33 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.654 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' A' ' 6' ' ' LYS . 61.5 tttp -166.81 71.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.88 0.371 . . . . 0.0 110.757 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.8 mtm-85 45.09 -93.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.117 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' N ' ' O ' ' A' ' 4' ' ' LYS . 79.5 mttt -145.8 77.4 1.5 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.552 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.486 ' CE3' ' O ' ' A' ' 7' ' ' TRP . 55.2 t90 -166.49 6.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.363 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.498 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.66 -73.25 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.264 -179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.34 13.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.188 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -39.75 -90.07 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.2 pt -82.82 -3.4 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -61.75 -47.37 90.75 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -43.13 -19.97 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.078 0.466 . . . . 0.0 110.249 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -93.83 -41.46 4.38 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.154 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.1 m -111.42 -43.15 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-N 116.908 0.354 . . . . 0.0 111.526 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 59.3 tttm -46.45 -52.03 13.95 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.811 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.9 mm -45.05 -59.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.686 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.5 tt -171.63 -17.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.76 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.79 63.41 5.12 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.835 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -167.81 -60.2 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 121.202 -0.523 . . . . 0.0 111.95 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.2 -65.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 110.466 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.55 66.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 tp -55.07 -19.73 7.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.165 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.474 ' O ' ' N ' ' A' ' 26' ' ' LEU . 22.3 t70 -160.29 61.02 0.34 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.395 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -49.18 90.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.655 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.474 ' N ' ' O ' ' A' ' 24' ' ' ASP . 31.3 tp . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.298 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.424 ' H3 ' ' H ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.503 ' CZ ' HH12 ' A' ' 5' ' ' ARG . 52.3 mtp180 -74.24 -72.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.733 0.301 . . . . 0.0 110.573 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 51.24 -99.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.322 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -87.07 123.34 32.04 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.264 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.503 HH12 ' CZ ' ' A' ' 2' ' ' ARG . 23.9 mmt180 -51.97 97.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.325 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.2 pttp 32.45 80.91 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.729 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.494 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 55.9 t-105 -168.13 -6.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.927 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.555 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.7 pt? -75.17 21.09 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.29 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.8 mmt-85 62.27 39.67 12.23 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.819 0.343 . . . . 0.0 110.462 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' O ' ' O ' ' A' ' 9' ' ' ARG . 3.0 ptp180 -48.32 -93.4 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.401 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 8.3 pt -83.77 -7.18 10.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -64.83 -43.04 96.7 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.704 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -13.49 0.36 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.264 0.554 . . . . 0.0 109.551 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -96.47 -42.43 3.42 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.06 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.6 m -112.93 -43.09 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 116.751 0.276 . . . . 0.0 111.031 -179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.7 tttt -57.76 -32.22 67.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.714 0.293 . . . . 0.0 110.611 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -67.23 3.01 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.2 mt 60.76 84.58 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.38 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.78 25.39 0.14 Allowed Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.841 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -167.79 -57.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.195 -0.526 . . . . 0.0 111.909 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.86 -54.0 34.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.786 0.327 . . . . 0.0 110.505 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.49 ' O ' ' NE2' ' A' ' 25' ' ' HIS . . . -65.89 -23.98 66.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.606 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 mt -84.24 65.06 8.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.488 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -160.16 -38.36 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.308 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.49 ' NE2' ' O ' ' A' ' 22' ' ' ALA . 13.0 p80 -77.01 131.3 38.37 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.435 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.104 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.426 ' H3 ' ' H ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.265 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.486 ' O ' ' N ' ' A' ' 4' ' ' LYS . 67.6 mtp180 -69.92 -76.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.683 0.278 . . . . 0.0 110.57 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.4 mmt-85 59.3 -77.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 6' ' ' LYS . 6.1 ptmm? -158.28 70.13 0.53 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.018 0.437 . . . . 0.0 110.695 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 56.27 -79.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.059 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.504 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.7 mttm -140.04 -157.87 0.81 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.602 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.502 ' C ' ' H ' ' A' ' 9' ' ' ARG . 11.2 t-105 73.53 -29.51 0.2 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.909 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.46 ' H ' ' C ' ' A' ' 6' ' ' LYS . 1.9 pt? -51.1 -10.37 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.195 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.502 ' H ' ' C ' ' A' ' 7' ' ' TRP . 12.3 tpp180 73.62 41.09 0.46 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.753 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -55.56 -91.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.8 pt -85.93 -13.79 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.15 -47.73 60.3 Favored Glycine 0 CA--C 1.508 -0.359 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.71 -20.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.308 0.575 . . . . 0.0 109.969 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -94.14 -44.19 3.6 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.549 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.3 m -104.19 -43.05 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 117.303 0.552 . . . . 0.0 111.037 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' C ' ' H ' ' A' ' 18' ' ' ILE . 20.2 tptp -47.48 -68.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.981 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.4 ' O ' ' O ' ' A' ' 18' ' ' ILE . 20.3 pt -74.87 33.48 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.168 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.508 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 51.08 100.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.732 0.301 . . . . 0.0 110.555 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.38 130.07 46.14 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.926 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -49.45 135.51 23.52 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.624 -0.591 . . . . 0.0 111.624 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.13 20.77 1.9 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.928 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 56.84 45.56 21.35 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 24.4 mt 55.54 22.12 4.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -177.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.438 ' C ' ' H ' ' A' ' 26' ' ' LEU . 1.8 p30 42.7 47.91 4.71 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.95 -178.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.407 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 56.1 t60 -77.15 39.28 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.726 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.438 ' H ' ' C ' ' A' ' 24' ' ' ASP . 10.1 mp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.066 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -172.7 43.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.757 0.313 . . . . 0.0 110.724 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.682 HH22 ' HZ3' ' A' ' 4' ' ' LYS . 33.5 ttp85 -59.99 -49.27 78.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.242 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.682 ' HZ3' HH22 ' A' ' 3' ' ' ARG . 50.9 mttp -83.97 -79.14 0.21 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.463 . . . . 0.0 110.314 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -170.23 -80.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.994 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -154.36 55.14 0.69 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.913 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -151.76 -5.93 0.25 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.382 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.412 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -53.38 -85.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 2.9 ppt_? -163.53 18.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.746 0.308 . . . . 0.0 111.004 179.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -44.15 -89.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.9 tp -77.23 -19.51 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.75 -40.86 89.88 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -46.37 -17.17 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.978 0.418 . . . . 0.0 110.461 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -101.46 -41.41 2.55 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.467 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -107.37 -41.08 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 116.824 0.312 . . . . 0.0 111.098 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 12' ' ' GLY . 40.6 tptt -66.67 -31.06 71.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.631 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.4 tt -45.28 -24.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' CG2' ' N ' ' A' ' 19' ' ' GLY . 16.9 tt -159.92 -48.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.796 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.453 ' N ' ' CG2' ' A' ' 18' ' ' ILE . . . 159.07 3.31 0.07 OUTLIER Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.124 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.502 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 64.08 3.9 10.05 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.813 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.38 9.42 1.04 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.923 0.392 . . . . 0.0 110.404 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.502 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -160.87 -44.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.23 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.499 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.2 mm? -80.75 57.32 2.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.974 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -167.99 -50.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.658 -179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -93.24 72.07 4.53 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.617 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.87 0.367 . . . . 0.0 110.121 179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 111.932 -0.467 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 53.91 62.92 2.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.869 0.366 . . . . 0.0 110.508 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 60.2 mtp180 -85.3 -20.86 29.36 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.503 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -134.54 46.62 2.46 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.364 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 42.57 -108.82 0.11 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.078 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.488 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 65.5 mmtt -114.48 68.95 0.7 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.32 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.4 m-90 -154.52 -10.44 0.13 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.23 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.576 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 2.0 pt? -69.1 5.54 1.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.463 ' H ' ' C ' ' A' ' 7' ' ' TRP . 37.9 mmm-85 60.54 43.54 12.79 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.75 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.422 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 5.2 ptm180 -52.7 -89.06 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.422 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 15.6 pt -86.24 -10.07 11.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -60.52 -40.33 97.61 Favored Glycine 0 C--N 1.336 0.542 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -52.3 -13.01 0.29 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.25 -42.15 1.95 Allowed Glycine 0 C--N 1.336 0.577 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.742 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.95 -39.7 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 117.184 0.492 . . . . 0.0 111.054 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.454 ' C ' ' H ' ' A' ' 18' ' ' ILE . 5.5 tmtt? -56.55 -64.48 0.85 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 tt -74.44 6.73 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.454 ' H ' ' C ' ' A' ' 16' ' ' LYS . 17.3 mt 62.08 109.25 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.475 179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -173.9 -109.62 0.23 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.41 -110.5 0.6 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.051 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.52 97.34 0.78 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 58.51 56.65 4.2 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt 59.23 20.02 8.1 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -177.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 43.33 38.63 1.77 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-O 122.127 0.965 . . . . 0.0 109.452 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -72.13 0.07 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 113.665 -1.607 . . . . 0.0 110.939 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.471 -179.957 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 mtt-85 52.55 72.18 0.42 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.846 0.355 . . . . 0.0 110.434 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -57.06 -43.52 82.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.762 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.508 ' O ' ' N ' ' A' ' 6' ' ' LYS . 38.2 mttm -142.42 44.35 1.63 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.437 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 58.0 -78.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.549 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 4' ' ' LYS . 80.6 mttt -136.19 -164.21 1.52 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.189 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.431 ' C ' ' H ' ' A' ' 9' ' ' ARG . 14.0 t90 72.9 -35.0 0.31 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.186 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 6' ' ' LYS . 1.1 pt? -68.03 3.17 1.68 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.125 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.698 ' H ' ' HE ' ' A' ' 9' ' ' ARG . 4.1 mmp_? 55.68 50.99 13.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.84 0.353 . . . . 0.0 110.509 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.503 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 14.9 ptt-85 -49.26 -53.92 19.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.472 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.503 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 12.5 tt -121.48 -19.3 4.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.483 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -56.33 -35.74 66.79 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.047 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.91 -12.34 0.31 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.236 0.541 . . . . 0.0 109.737 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.483 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -103.78 -44.66 1.62 Allowed Glycine 0 C--N 1.334 0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.416 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.44 -41.86 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.991 0.396 . . . . 0.0 111.298 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' N ' ' O ' ' A' ' 12' ' ' GLY . 56.9 mttp -68.55 -34.39 75.75 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.229 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 8.6 tp -50.56 -39.26 17.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.811 0.339 . . . . 0.0 110.44 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 4.4 tp -103.28 -19.07 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.18 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -41.62 -26.72 0.27 Allowed Glycine 0 C--N 1.331 0.255 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.582 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.21 -57.5 3.65 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 121.197 -0.525 . . . . 0.0 111.932 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.45 -35.48 19.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.983 0.421 . . . . 0.0 110.127 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -84.72 -50.66 7.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.979 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.07 69.39 6.45 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.355 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -168.84 -36.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -71.84 81.04 0.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.546 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.636 -179.884 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 111.879 -0.489 . . . . 0.0 111.879 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.526 ' NE ' ' HZ1' ' A' ' 6' ' ' LYS . 75.4 ttt180 -54.38 -16.92 2.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.223 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.61 -16.0 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.79 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -86.04 11.05 12.49 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.87 0.367 . . . . 0.0 110.289 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 57.16 66.38 1.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.421 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.526 ' HZ1' ' NE ' ' A' ' 2' ' ' ARG . 62.6 mmtt 58.1 88.36 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.736 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.426 ' H ' ' H ' ' A' ' 8' ' ' LEU . 63.1 t-105 -169.36 -8.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.577 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.45 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -39.33 -70.67 0.1 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.768 179.804 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.75 8.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.833 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.452 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 4.2 ptm180 -33.43 -48.09 0.24 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.282 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.452 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 9.4 tt -126.35 -18.25 2.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.33 -37.74 82.85 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.96 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -51.47 -13.9 0.26 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.185 0.517 . . . . 0.0 109.741 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.487 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.15 -46.15 1.92 Allowed Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.194 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -104.54 -40.01 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 116.872 0.336 . . . . 0.0 111.219 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' A' ' 12' ' ' GLY . 54.0 tttm -60.08 -35.81 76.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.3 tp -70.07 4.05 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.981 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.459 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.6 mm 58.13 87.51 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.093 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.13 21.75 0.13 Allowed Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -172.38 -37.26 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.22 -78.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.305 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.16 -27.99 53.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.387 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.6 tp -78.52 53.8 1.36 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.486 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.424 ' H ' ' H ' ' A' ' 25' ' ' HIS . 32.5 t70 -170.28 -4.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.356 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.424 ' H ' ' H ' ' A' ' 24' ' ' ASP . 33.8 t-80 -66.73 -75.24 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.566 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.51 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.2 mm? . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.083 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 4' ' ' LYS . 34.8 ptt85 -166.04 -34.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.81 0.338 . . . . 0.0 110.422 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.487 ' C ' ' H ' ' A' ' 5' ' ' ARG . 78.9 mtm180 48.9 -90.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.877 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 6' ' ' LYS . 86.1 mttt -77.21 36.08 0.18 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.762 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.487 ' H ' ' C ' ' A' ' 3' ' ' ARG . 98.2 mtt180 57.14 -78.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.823 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 4' ' ' LYS . 15.1 ptpt -159.97 66.34 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.073 0.463 . . . . 0.0 110.183 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.476 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 75.6 t-105 -155.42 11.85 0.33 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.41 69.47 4.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.996 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 48.49 27.47 1.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.933 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -51.01 -89.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -83.88 -17.74 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.086 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.01 -46.27 69.81 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.194 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.3 -14.49 0.17 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.01 0.433 . . . . 0.0 110.047 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.489 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -97.55 -33.36 5.92 Favored Glycine 0 C--N 1.334 0.437 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.415 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.7 m -122.58 -42.3 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 116.895 0.347 . . . . 0.0 111.044 -179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' C ' ' H ' ' A' ' 18' ' ' ILE . 82.8 tttt -56.67 -34.42 67.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.784 0.326 . . . . 0.0 110.431 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.8 tt -62.66 -1.0 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.512 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.8 mt 63.48 88.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.356 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.48 22.76 0.12 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.734 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.496 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -172.05 -23.72 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.98 11.75 0.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.937 0.399 . . . . 0.0 110.358 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.496 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.96 -44.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.161 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.8 mt -79.88 54.93 1.96 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.384 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 26' ' ' LEU . 24.0 t0 -162.65 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.387 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 12.3 m-70 -76.78 35.44 0.15 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.6 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 24' ' ' ASP . 14.8 mt . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.523 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 111.966 -0.453 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -73.37 74.4 1.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.729 0.299 . . . . 0.0 110.588 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 73.0 mtp180 -70.54 -62.34 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.542 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 80.2 mttt -96.73 49.12 1.08 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.685 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 53.63 -85.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.672 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' LYS . 92.9 mttt -142.88 78.41 1.61 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.278 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.481 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 77.0 t-105 -170.61 8.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.461 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.429 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -75.2 -92.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.051 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 11' ' ' ILE . 1.2 ppt_? -170.17 25.03 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.469 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.684 ' C ' ' H ' ' A' ' 12' ' ' GLY . 7.4 ptp180 -60.31 78.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.433 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.489 ' N ' ' O ' ' A' ' 9' ' ' ARG . 6.8 pt 55.77 -11.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.546 -178.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.684 ' H ' ' C ' ' A' ' 10' ' ' ARG . . . -72.55 -24.56 76.0 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -53.45 -15.76 1.19 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.426 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.22 -49.58 1.05 Allowed Glycine 0 C--N 1.337 0.602 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.652 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.6 m -96.63 -35.04 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 117.014 0.407 . . . . 0.0 111.538 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.467 ' N ' ' O ' ' A' ' 12' ' ' GLY . 61.4 tttm -76.87 -29.14 55.67 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.118 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.3 tp -55.13 -32.67 28.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.624 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.498 ' C ' ' H ' ' A' ' 20' ' ' GLY . 9.6 tt -167.54 -23.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.908 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.23 17.92 1.31 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.36 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.507 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -167.07 -47.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.87 2.25 1.51 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.915 0.388 . . . . 0.0 110.298 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.507 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -153.54 -38.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.227 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.6 tp -79.95 51.89 1.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.367 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.426 ' H ' ' H ' ' A' ' 25' ' ' HIS . 39.0 t70 -166.48 -9.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.66 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.426 ' H ' ' H ' ' A' ' 24' ' ' ASP . 38.4 t60 -70.0 -60.08 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.689 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.447 179.971 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.418 ' NH2' ' HZ1' ' A' ' 6' ' ' LYS . 54.7 mtp180 52.3 44.56 29.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.1 mtt85 -74.08 -2.34 24.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.656 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -161.68 71.24 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.588 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.5 mtm105 49.42 -108.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.665 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.554 ' HZ3' ' NH1' ' A' ' 10' ' ' ARG . 58.1 mttm -145.9 90.93 2.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.779 0.323 . . . . 0.0 110.223 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.486 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 30.7 t-105 -167.49 -14.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.765 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.484 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.55 -78.54 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.165 -179.677 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.507 ' O ' ' N ' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -177.37 18.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.574 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.686 ' C ' ' H ' ' A' ' 12' ' ' GLY . 4.6 ptp180 -57.5 78.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.313 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 9' ' ' ARG . 2.2 mm 61.72 -18.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.239 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.686 ' H ' ' C ' ' A' ' 10' ' ' ARG . . . -66.37 -30.4 76.57 Favored Glycine 0 N--CA 1.441 -1.012 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 178.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -52.43 -14.16 0.45 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.079 0.466 . . . . 0.0 109.786 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.456 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -108.53 -46.64 0.97 Allowed Glycine 0 C--N 1.337 0.595 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.569 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.4 m -99.19 -34.19 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 117.068 0.434 . . . . 0.0 111.518 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 12' ' ' GLY . 52.8 tttp -74.22 -39.7 62.93 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.03 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.1 tt -51.87 -37.57 21.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.298 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.457 ' CG1' ' H ' ' A' ' 19' ' ' GLY . 1.1 pt -105.27 -96.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.469 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 171.69 12.92 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.98 -10.07 3.42 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.866 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.469 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -66.57 -52.25 47.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 110.345 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.493 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -63.95 -34.42 77.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.427 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 tp -76.26 38.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.293 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.493 ' H ' ' C ' ' A' ' 22' ' ' ALA . 37.9 t70 -168.31 -58.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.575 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 51.14 56.33 8.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.508 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.47 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.7 mp . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.064 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.261 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.0 mtm-85 -76.32 36.16 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.585 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.492 ' H ' ' C ' ' A' ' 1' ' ' GLY . 61.8 mtt-85 -78.47 -29.47 46.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.642 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -144.55 23.11 1.62 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.434 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 57.21 65.45 1.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.577 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp 48.07 85.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.649 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' C ' ' H ' ' A' ' 9' ' ' ARG . 41.9 t-105 -166.74 -19.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.574 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.551 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.7 pt? -52.05 -10.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.503 ' H ' ' C ' ' A' ' 7' ' ' TRP . 7.7 tpp180 72.95 33.9 1.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.501 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -50.72 -91.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.6 tt -84.22 -20.38 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.273 179.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.488 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -52.75 -42.2 58.84 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.706 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -46.23 -16.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.096 0.474 . . . . 0.0 110.436 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.488 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.77 -42.52 2.46 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.551 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.53 -41.02 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 116.996 0.398 . . . . 0.0 111.29 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' C ' ' H ' ' A' ' 18' ' ' ILE . 57.9 tttp -55.32 -51.14 67.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.868 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.9 tp -74.23 14.96 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.064 0.459 . . . . 0.0 110.442 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.505 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mm 57.14 101.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.402 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.82 92.62 0.82 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.197 -0.525 . . . . 0.0 112.005 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.475 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -58.15 -159.04 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.852 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.71 14.47 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.072 0.463 . . . . 0.0 110.293 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.475 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -171.98 -61.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.057 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 tt -83.81 44.73 1.01 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -164.78 14.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.472 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.543 ' HD1' ' N ' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.56 137.23 53.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.635 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 7.0 mp . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.252 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.494 ' C ' ' H ' ' A' ' 4' ' ' LYS . 14.3 ptm180 -161.89 30.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.414 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -54.16 -9.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.486 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' H ' ' C ' ' A' ' 2' ' ' ARG . 32.3 ttmt -168.24 62.5 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.399 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.7 mmt-85 47.4 -174.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.603 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.436 ' O ' ' CZ ' ' A' ' 10' ' ' ARG . 78.7 mttt -82.69 76.17 9.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.406 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -168.64 0.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.524 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.455 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.46 -65.33 0.58 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.908 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.0 tpp85 -169.63 22.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.179 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' CZ ' ' O ' ' A' ' 6' ' ' LYS . 7.0 ptt180 -48.88 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 tp -78.16 -21.38 13.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.53 -35.79 68.09 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 5.5 ttpm? -49.47 -14.78 0.12 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.1 -45.0 1.53 Allowed Glycine 0 C--N 1.336 0.577 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.426 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -101.92 -39.36 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 116.844 0.322 . . . . 0.0 110.934 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 37.3 tptt -68.3 -34.04 75.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.807 0.337 . . . . 0.0 110.46 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.583 ' CG2' ' H ' ' A' ' 18' ' ' ILE . 9.1 tt -47.71 -64.93 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.455 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.583 ' H ' ' CG2' ' A' ' 17' ' ' ILE . 9.6 pt -157.34 37.79 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.83 22.15 1.2 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 121.22 -0.514 . . . . 0.0 111.997 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.512 ' H ' ' C ' ' A' ' 18' ' ' ILE . . . 79.87 -15.63 14.61 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 111.94 -0.464 . . . . 0.0 111.94 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.74 -64.48 0.85 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.426 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.19 -35.97 69.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.484 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 21.5 tp -77.06 68.6 3.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.249 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -167.17 -12.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.419 -179.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.584 ' HD1' ' N ' ' A' ' 25' ' ' HIS . 0.5 OUTLIER -55.3 139.44 42.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.608 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.4 mm? . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.085 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.551 ' NH1' HH22 ' A' ' 5' ' ' ARG . 4.7 ptp180 -46.17 94.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.16 0.505 . . . . 0.0 110.783 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.41 ' N ' ' O ' ' A' ' 1' ' ' GLY . 94.8 mtt180 -66.29 -30.46 70.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.529 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -164.67 65.93 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.502 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.551 HH22 ' NH1' ' A' ' 2' ' ' ARG . 15.9 mmm180 49.9 17.82 0.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.6 mttm 55.94 78.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.404 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.471 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 30.0 t90 -168.18 5.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.759 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -55.0 -88.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.331 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.509 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 8.4 mmm180 -140.23 9.24 2.29 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.266 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 4.5 ptm180 -42.33 -86.22 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.691 0.281 . . . . 0.0 110.583 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.43 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.5 tp -87.45 -17.26 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.64 -41.4 82.01 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.4 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -49.51 -16.1 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.092 0.472 . . . . 0.0 109.99 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -98.05 -39.0 3.91 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.513 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.6 m -113.79 -42.1 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 CA-C-N 116.94 0.37 . . . . 0.0 111.365 -179.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.5 ' C ' ' H ' ' A' ' 18' ' ' ILE . 56.2 tttp -51.04 -51.03 57.2 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.615 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.5 tt -77.8 38.33 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.325 0.584 . . . . 0.0 110.09 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.5 ' H ' ' C ' ' A' ' 16' ' ' LYS . 30.0 pt 35.17 51.32 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.725 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.511 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . 74.79 -75.88 1.23 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.878 -0.489 . . . . 0.0 111.878 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 46.61 -88.1 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -49.36 -29.22 5.89 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.92 -51.01 4.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.075 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -75.25 73.62 2.36 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.988 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -172.11 -22.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.223 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -65.07 -6.34 8.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.397 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.43 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.8 mp . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.143 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -166.03 130.0 2.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.932 0.396 . . . . 0.0 110.645 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -171.76 -30.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.274 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -164.66 60.06 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.233 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 49.4 mtp85 48.63 -172.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.68 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.478 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 22.7 mtmm -80.36 70.84 7.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.996 0.427 . . . . 0.0 110.56 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' C ' ' H ' ' A' ' 9' ' ' ARG . 95.6 m95 -158.81 -3.45 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.596 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.437 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 0.9 OUTLIER -68.87 8.77 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.073 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.498 ' H ' ' C ' ' A' ' 7' ' ' TRP . 19.6 mmt180 64.2 44.2 4.56 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.054 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.411 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 4.1 ptp180 -51.95 -93.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.411 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 11.3 pt -84.88 -6.08 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.554 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -61.32 -46.43 94.44 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.763 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -45.09 -17.18 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.123 0.487 . . . . 0.0 110.373 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -97.12 -44.23 2.85 Favored Glycine 0 C--N 1.336 0.532 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.771 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.8 m -107.24 -42.41 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 120.615 0.245 . . . . 0.0 110.649 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.554 ' N ' ' O ' ' A' ' 12' ' ' GLY . 34.5 tptt -66.18 -41.37 90.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.001 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.7 tt -40.2 -23.73 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.886 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.467 ' N ' ' O ' ' A' ' 16' ' ' LYS . 10.3 tp -158.7 -46.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.718 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 70.86 60.2 4.7 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.93 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 172.15 -71.14 0.11 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.823 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.41 -55.42 31.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.261 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.99 -17.37 62.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.296 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 tt -79.47 55.23 1.89 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.288 0.566 . . . . 0.0 109.614 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -162.24 -47.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.825 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 54.53 82.92 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.641 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.33 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.092 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -172.41 160.47 4.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.819 0.342 . . . . 0.0 110.618 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.487 ' C ' ' H ' ' A' ' 5' ' ' ARG . 66.4 mtm180 -145.13 -78.66 0.19 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.243 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -75.59 14.79 0.57 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.442 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.487 ' H ' ' C ' ' A' ' 3' ' ' ARG . 3.9 tpt180 54.1 68.52 0.84 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.571 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.6 mttt 51.61 89.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.529 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 32.3 t-105 -168.86 -14.83 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.81 -16.35 58.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.812 179.193 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' NH2' ' HZ3' ' A' ' 16' ' ' LYS . 30.5 mmt180 53.57 64.67 1.76 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.661 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 11.8 ptm180 -95.3 -47.27 6.39 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.033 0.444 . . . . 0.0 110.68 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.481 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 9.4 tp -129.95 -21.97 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.11 -36.17 73.31 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.748 178.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -52.91 -18.91 2.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.828 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -94.26 -36.57 5.65 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.24 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.4 m -118.97 -45.77 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.9 tttm -49.35 -47.53 47.31 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.164 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.456 ' CG2' ' N ' ' A' ' 18' ' ' ILE . 10.1 tp -70.7 -48.27 59.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.313 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.456 ' N ' ' CG2' ' A' ' 17' ' ' ILE . 37.2 mt -136.02 89.71 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.496 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 155.22 -18.0 0.53 Allowed Glycine 0 C--N 1.331 0.262 0 N-CA-C 111.554 -0.618 . . . . 0.0 111.554 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.92 -9.82 0.35 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.057 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.496 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . 56.82 19.32 4.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.908 0.385 . . . . 0.0 110.452 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.419 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -168.69 -33.3 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.133 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.15 26.46 0.63 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.239 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.419 ' H ' ' C ' ' A' ' 22' ' ' ALA . 26.7 t0 -164.43 -43.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.51 -179.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 54.29 87.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.072 179.933 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -77.44 44.91 0.45 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.742 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -54.14 -27.93 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.658 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -149.84 51.47 0.92 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' TRP . 24.6 ttt-85 61.07 137.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.328 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -48.72 88.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.627 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.496 ' N ' ' O ' ' A' ' 5' ' ' ARG . 47.6 t90 -167.19 -9.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 -179.735 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.444 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.7 -74.74 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 121.034 -0.267 . . . . 0.0 110.444 -179.807 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 mmm-85 176.04 20.72 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER -48.36 -88.5 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.15 179.747 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.42 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.6 tp -84.13 -17.87 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.914 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.543 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.31 -43.33 64.85 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -45.7 -18.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.016 0.436 . . . . 0.0 110.391 179.209 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.9 -42.26 3.61 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.071 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -107.87 -44.38 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 116.653 0.227 . . . . 0.0 110.855 -179.742 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.59 ' C ' ' H ' ' A' ' 18' ' ' ILE . 60.1 tttm -58.86 -27.0 64.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.725 179.898 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -70.49 25.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.951 0.405 . . . . 0.0 110.779 179.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.59 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.6 mt 61.85 94.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 110.348 179.922 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.418 ' H ' ' H ' ' A' ' 20' ' ' GLY . . . 170.52 1.76 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.742 179.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.418 ' H ' ' H ' ' A' ' 19' ' ' GLY . . . -168.85 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.201 -0.523 . . . . 0.0 111.964 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.42 -42.31 62.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.869 0.366 . . . . 0.0 110.484 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.457 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -75.48 -17.21 60.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.504 179.884 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -68.27 1.51 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.108 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 22' ' ' ALA . 36.5 t70 -164.83 -56.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.686 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.47 ' ND1' ' N ' ' A' ' 26' ' ' LEU . 66.7 t-80 57.88 157.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.47 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 14.9 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.472 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.417 ' H2 ' ' H ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' H ' ' H2 ' ' A' ' 1' ' ' GLY . 63.9 mtp180 -78.51 43.72 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 110.659 -179.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.4 ' H ' ' C ' ' A' ' 1' ' ' GLY . 51.7 ttp180 -68.3 -36.69 79.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.565 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.75 71.25 0.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.156 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.501 ' O ' ' N ' ' A' ' 7' ' ' TRP . 7.3 tpm_? 61.66 131.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.309 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -54.75 82.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.065 -179.562 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.511 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 70.2 t90 -173.26 13.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.628 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.581 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 2.0 pt? -70.8 -37.6 73.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.924 -179.156 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.88 22.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.23 -179.666 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -51.78 -88.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.7 tp -82.98 -21.11 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.051 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.47 -37.14 59.68 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.445 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -46.53 -18.27 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 0.0 110.409 179.001 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.447 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -102.27 -44.14 1.91 Allowed Glycine 0 C--N 1.334 0.464 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.503 -179.659 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.6 m -103.43 -39.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 116.889 0.345 . . . . 0.0 111.161 -179.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 61.1 tttp -68.57 -32.44 72.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.1 tt -44.96 -26.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.924 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.3 mt -135.27 -78.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.45 -2.79 0.06 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 121.262 -0.494 . . . . 0.0 111.969 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.487 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 76.21 -5.43 42.63 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 121.203 -0.522 . . . . 0.0 111.978 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.43 19.28 0.26 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.802 0.334 . . . . 0.0 110.527 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.487 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -160.87 -46.89 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tp -78.23 58.71 2.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.362 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -170.16 -16.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.6 t-80 -77.74 62.3 2.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.687 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.545 179.883 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 46.5 ttt85 -170.66 -18.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.773 0.321 . . . . 0.0 110.483 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 82.7 mtm180 -53.19 -23.99 9.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.732 -179.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.5 mttp -146.04 47.24 1.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.399 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.8 mtm180 51.34 -99.66 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.375 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.7 mtmm -138.54 77.19 1.61 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.952 179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 88.0 t90 -163.96 5.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.95 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.61 6.05 29.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.861 179.892 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 54.13 55.48 8.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.893 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 5.0 ptm180 -54.2 -50.16 67.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.109 0.48 . . . . 0.0 109.944 179.66 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.465 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 15.7 tt -126.66 -18.45 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.836 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.483 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -56.34 -31.07 59.28 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 178.782 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttpp -53.59 -11.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.163 0.506 . . . . 0.0 109.813 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.483 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -108.43 -46.29 1.0 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.487 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.9 m -97.47 -39.35 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 117.005 0.402 . . . . 0.0 111.607 -179.329 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -73.93 -33.82 64.1 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.588 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.3 tt -45.97 -40.22 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.442 -179.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.1 tt -160.82 33.52 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.395 0.617 . . . . 0.0 110.672 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -149.25 18.85 1.19 Allowed Glycine 0 C--N 1.331 0.277 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -163.64 -50.39 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.89 -80.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.782 0.325 . . . . 0.0 110.26 179.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.55 -27.0 67.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.15 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.61 64.14 2.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.306 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.496 ' C ' ' H ' ' A' ' 26' ' ' LEU . 17.6 t70 -170.76 -25.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.603 -179.985 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.505 ' HD1' ' N ' ' A' ' 25' ' ' HIS . 1.1 m-70 -76.82 33.64 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.728 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.496 ' H ' ' C ' ' A' ' 24' ' ' ASP . 13.2 mt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.512 179.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 111.96 -0.456 . . . . 0.0 111.96 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.465 ' NH1' ' O ' ' A' ' 2' ' ' ARG . 2.9 ptm180 -53.39 85.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.981 0.419 . . . . 0.0 110.432 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 1' ' ' GLY . 44.7 mtp85 -53.63 -48.96 68.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -161.59 63.75 0.26 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.897 0.38 . . . . 0.0 110.484 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER 53.44 -103.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.061 179.809 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -96.35 178.37 5.39 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.645 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 47.0 m95 58.28 20.31 7.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.982 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.87 -61.76 1.95 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.041 0.448 . . . . 0.0 109.864 179.824 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -167.18 15.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.444 179.844 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -48.12 -87.36 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.02 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.2 pt -84.49 -18.08 9.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.842 0.353 . . . . 0.0 110.085 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.32 -38.46 68.79 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -49.58 -15.72 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.165 0.507 . . . . 0.0 109.892 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.62 -45.8 1.9 Allowed Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.329 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -101.19 -41.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 117.032 0.416 . . . . 0.0 111.063 -179.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' C ' ' H ' ' A' ' 18' ' ' ILE . 9.1 tmtm? -59.19 -36.99 76.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.9 tt -63.82 -0.38 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.097 179.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.515 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.9 mt 63.15 94.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.241 -179.847 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -175.39 1.14 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.755 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -67.93 162.77 48.26 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.236 -0.507 . . . . 0.0 111.906 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.93 -54.68 18.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.847 0.356 . . . . 0.0 110.493 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.499 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -76.94 -33.43 57.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.419 179.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.514 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.2 mm? -77.85 36.0 0.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.899 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.499 ' H ' ' C ' ' A' ' 22' ' ' ALA . 22.3 t0 -167.37 -71.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.4 ' O ' ' O ' ' A' ' 24' ' ' ASP . 45.0 t60 53.49 103.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.511 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.426 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.5 mp . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.11 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.401 ' O ' ' O ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 1' ' ' GLY . 84.2 mtt180 60.4 134.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.976 0.417 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -171.38 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.19 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -93.38 26.45 2.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.215 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 9.8 mpt_? 53.7 58.02 5.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.159 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.9 mttt 51.65 79.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.412 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.474 ' CD2' ' O ' ' A' ' 7' ' ' TRP . 83.5 t90 -160.33 6.3 0.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.139 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.77 24.41 0.89 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.686 179.816 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.407 ' H ' ' C ' ' A' ' 7' ' ' TRP . 10.1 mmt85 58.69 39.3 24.58 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.847 179.593 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 2.3 ptp180 -52.58 -92.9 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.772 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.408 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 19.6 tt -80.85 -15.25 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.502 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -57.03 -39.53 89.79 Favored Glycine 0 C--N 1.335 0.503 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.495 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -51.5 -12.73 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.463 . . . . 0.0 109.821 178.846 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -106.28 -41.52 1.76 Allowed Glycine 0 C--N 1.338 0.64 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.783 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.52 -38.24 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 117.314 0.557 . . . . 0.0 111.01 -179.299 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.448 ' N ' ' O ' ' A' ' 12' ' ' GLY . 6.1 tmtt? -59.29 -61.26 2.76 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.472 ' O ' ' CB ' ' A' ' 18' ' ' ILE . 17.2 tt -51.82 -34.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.385 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.472 ' CB ' ' O ' ' A' ' 17' ' ' ILE . 17.2 tt 126.23 107.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 124.888 1.368 . . . . 0.0 110.077 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.86 70.56 1.81 Allowed Glycine 0 C--N 1.334 0.436 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 179.8 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.3 -39.37 9.68 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 121.332 -0.461 . . . . 0.0 112.342 -179.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.0 -55.57 11.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.817 0.341 . . . . 0.0 110.56 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.91 -50.27 50.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.309 179.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.59 67.83 2.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.424 179.879 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -171.58 -23.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.452 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -73.45 -37.17 65.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.453 179.905 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.6 ptp85 -172.26 49.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.799 0.333 . . . . 0.0 110.484 -179.938 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -71.67 -31.31 66.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -143.32 25.65 1.69 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.275 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 74.08 -65.19 0.36 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.23 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -146.78 166.69 25.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.357 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 23.7 m95 63.35 15.69 8.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.316 179.589 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.479 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.47 -70.45 0.09 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.854 0.359 . . . . 0.0 110.332 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.47 15.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.08 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 5.7 ptm180 -42.63 -89.14 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.194 179.586 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.405 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.5 tp -77.12 -20.29 14.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.427 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.6 -42.08 90.13 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -48.02 -15.46 0.07 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.968 0.414 . . . . 0.0 110.071 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.493 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -99.82 -41.71 2.83 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.403 -179.969 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.9 m -105.96 -42.96 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 116.961 0.381 . . . . 0.0 110.679 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.1 tttp -56.41 -38.67 71.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.833 0.349 . . . . 0.0 110.381 179.72 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 tt -64.27 0.35 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.503 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.7 mt 61.67 66.46 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.166 -179.796 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.25 -176.75 14.52 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.149 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.96 86.99 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.26 -0.495 . . . . 0.0 111.979 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -54.14 49.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.49 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.77 -21.37 66.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.426 179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 tp -67.61 -5.06 13.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.248 -179.927 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.495 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 34.2 t70 -160.73 13.32 0.11 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.686 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.495 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 34.5 p-80 40.9 27.04 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.2 179.995 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.9 tp . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.357 179.999 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.018 -0.433 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.7 ttm-85 60.39 47.8 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.165 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -77.86 -27.48 49.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.417 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -164.8 63.85 0.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.366 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 52.42 -106.06 0.26 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.323 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 96.1 mttt -141.63 70.66 1.34 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.817 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.496 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.0 m-90 -160.05 3.51 0.08 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.315 -179.712 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.407 ' CD2' ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -64.38 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.82 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -169.26 19.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.828 179.419 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -39.21 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.7 tt -83.3 -17.18 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.95 -42.8 81.59 Favored Glycine 0 N--CA 1.451 -0.364 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 179.558 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -47.93 -15.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.961 0.41 . . . . 0.0 110.234 179.206 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.488 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -103.62 -40.44 2.36 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.543 -179.847 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -107.24 -40.6 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 116.935 0.367 . . . . 0.0 110.981 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 12' ' ' GLY . 34.9 ttpt -56.67 -60.48 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.481 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -73.94 10.91 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 109.986 179.94 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.493 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.0 mt 57.4 87.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.437 179.994 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.33 93.22 1.1 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.328 -0.463 . . . . 0.0 111.998 179.922 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -60.61 -10.66 18.83 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.153 -0.546 . . . . 0.0 111.854 179.966 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.23 10.71 0.9 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.781 0.324 . . . . 0.0 110.46 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.491 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.79 -47.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.453 -179.926 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 tt -76.64 39.62 0.22 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.914 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.486 ' H ' ' C ' ' A' ' 22' ' ' ALA . 18.7 t70 -170.22 1.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.416 ' H ' ' H ' ' A' ' 24' ' ' ASP . 79.3 t60 -54.67 -14.45 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.454 179.996 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 pp . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 -179.899 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.464 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 111.916 -0.474 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -79.11 25.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.744 0.306 . . . . 0.0 110.477 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.464 ' H ' ' C ' ' A' ' 1' ' ' GLY . 36.6 ttm180 -60.25 -26.44 66.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.595 179.964 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' O ' ' O ' ' A' ' 5' ' ' ARG . 56.0 tttm -161.55 44.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.863 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' TRP . 15.2 tpp180 60.6 137.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.22 -179.596 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.84 88.0 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.082 0.468 . . . . 0.0 110.26 -179.89 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.513 ' N ' ' O ' ' A' ' 5' ' ' ARG . 64.6 t-105 -170.96 -20.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.403 -179.788 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 77.65 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.889 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 7' ' ' TRP . 23.8 mmt180 45.71 25.67 0.29 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.443 179.068 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -45.93 -88.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.3 pt -86.71 -14.56 10.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 178.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.38 -37.87 83.85 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -52.57 -13.69 0.41 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -98.83 -44.8 2.38 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.162 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.7 m -106.64 -42.83 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 116.914 0.357 . . . . 0.0 111.239 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.0 tptm -53.99 -42.07 68.62 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.433 -179.589 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.2 tp -50.43 -56.02 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.488 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.444 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 13.4 tt -174.02 107.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.208 0.528 . . . . 0.0 110.431 178.723 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.6 77.28 2.12 Favored Glycine 0 C--N 1.331 0.296 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.98 -39.39 6.4 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.353 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.92 -49.96 58.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.686 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.4 -47.7 19.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.9 tt -77.6 60.6 2.18 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -171.87 9.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.46 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -48.34 151.58 1.03 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.746 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.319 -179.869 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.435 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.232 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -61.46 81.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.792 0.33 . . . . 0.0 110.482 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.435 ' N ' ' O ' ' A' ' 1' ' ' GLY . 60.4 ttm-85 -75.2 -27.94 59.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.666 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -145.8 50.37 1.19 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.478 -179.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 50.69 -94.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.0 mttp -144.33 88.12 1.92 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.475 -179.839 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 42.7 t90 -171.37 -6.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.487 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.9 -74.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.218 -179.714 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.97 19.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.557 -179.977 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.76 -89.37 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.141 179.696 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.4 pt -84.48 -13.23 11.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.229 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.509 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.67 -45.18 85.88 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.95 -15.33 0.19 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.497 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -101.53 -43.66 2.11 Favored Glycine 0 C--N 1.336 0.549 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.361 179.998 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.54 -40.83 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.09 0.445 . . . . 0.0 110.978 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 12' ' ' GLY . 10.9 ttmm -51.85 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.354 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 pt -73.56 12.45 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.594 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.486 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.7 mt 59.98 100.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.378 179.994 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -74.1 91.48 0.72 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.869 179.911 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -45.06 -19.11 0.17 Allowed Glycine 0 C--N 1.33 0.224 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.294 -179.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 19' ' ' GLY . . . -53.48 -74.01 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.799 0.333 . . . . 0.0 110.394 179.99 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -81.45 -37.69 27.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.564 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.0 mm? -73.89 69.62 1.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.14 -179.962 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -171.08 -34.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.504 179.905 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -65.7 -71.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.525 179.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.509 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.5 mm? . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.008 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -60.44 125.45 23.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.789 0.328 . . . . 0.0 110.533 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -73.76 -52.5 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.677 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -140.66 25.23 2.19 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.122 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' TRP . 83.8 mtm180 54.01 -175.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 -179.611 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -65.79 76.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.414 179.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.406 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 56.5 t-105 -170.69 -5.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.729 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.446 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -45.69 -73.07 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.418 -179.865 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.74 18.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.195 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -41.93 -89.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.264 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.3 pt -87.87 -11.5 10.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.05 -45.73 80.56 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.811 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -45.42 -17.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 178.836 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.75 -41.66 3.54 Favored Glycine 0 C--N 1.335 0.514 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.249 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -108.33 -44.08 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 116.777 0.289 . . . . 0.0 111.023 -179.654 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' C ' ' H ' ' A' ' 18' ' ' ILE . 16.6 ttpp -53.36 -37.68 62.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.77 0.319 . . . . 0.0 110.634 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.5 tt -71.37 14.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.664 -179.73 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.532 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.5 mt 60.23 108.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.85 0.357 . . . . 0.0 110.485 179.977 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.09 1.53 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -175.4 2.96 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.942 -179.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.12 -78.73 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 -179.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -70.24 -26.33 63.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.456 179.924 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.509 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.5 mm? -79.9 36.76 0.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.129 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.44 ' H ' ' C ' ' A' ' 22' ' ' ALA . 13.5 t70 -168.88 -23.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.699 -179.989 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 59.6 t60 54.19 63.57 2.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.405 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.413 -179.956 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -76.74 63.37 2.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.74 0.305 . . . . 0.0 110.492 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -75.49 -34.96 60.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.548 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 6' ' ' LYS . 75.4 mttt -145.65 30.07 1.11 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.361 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.2 mmt85 57.45 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.683 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 4' ' ' LYS . 81.9 mttt -145.69 75.98 1.45 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.871 0.367 . . . . 0.0 110.179 179.888 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 70.9 t-105 -166.09 7.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.58 -179.805 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.438 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.52 -89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.825 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -169.51 27.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.544 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -50.65 -89.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.315 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 pt -84.03 -16.35 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.042 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.56 -41.43 64.57 Favored Glycine 0 N--CA 1.45 -0.372 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.622 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' CB ' ' NZ ' ' A' ' 13' ' ' LYS . 5.4 ttpm? -44.13 -19.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.01 0.433 . . . . 0.0 110.207 178.81 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -100.88 -44.23 2.11 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.493 -179.734 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.3 m -104.25 -40.53 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 116.974 0.387 . . . . 0.0 111.282 -179.4 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.8 tttt -69.52 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.883 -179.724 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.8 tt -48.1 -26.14 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.541 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.3 mt -135.25 -78.17 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.468 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 155.94 32.02 0.03 OUTLIER Glycine 0 C--N 1.333 0.38 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 179.884 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.5 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 64.49 2.38 7.35 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.737 -179.772 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -77.65 25.77 0.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 -179.935 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.5 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.41 -43.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.467 -179.961 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.4 tp -78.08 45.75 0.55 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.276 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -169.63 -40.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.557 -179.957 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 60.1 133.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 7.8 mp . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.11 179.974 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.382 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' LYS . 42.1 mtp85 -69.85 -69.42 0.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.58 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 60.63 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.81 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' ARG . 78.2 tttt -154.11 51.14 0.66 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.972 0.415 . . . . 0.0 110.161 179.971 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 47.36 40.43 10.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.581 -179.854 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 54.7 84.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.484 -179.997 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.469 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 77.0 t-105 -171.24 8.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.521 -179.99 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.485 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.23 -70.49 0.09 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.228 -179.907 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.75 14.82 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.767 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -45.88 -87.77 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.242 179.719 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.0 mm -84.88 -18.96 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.736 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.25 -40.12 83.62 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.565 -0.826 . . . . 0.0 111.064 179.558 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -49.44 -16.22 0.19 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.189 0.518 . . . . 0.0 109.864 178.813 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.35 -45.98 1.91 Allowed Glycine 0 C--N 1.333 0.407 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.182 179.844 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -102.2 -41.05 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 116.873 0.336 . . . . 0.0 111.301 -179.559 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.8 tttp -57.38 -41.72 80.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.729 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.8 tt -68.3 4.62 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 121.01 0.433 . . . . 0.0 110.163 179.908 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.497 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.9 mt 61.3 101.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.36 -179.767 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.28 -75.78 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.833 179.986 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.9 -29.18 72.55 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.14 -0.553 . . . . 0.0 111.814 179.837 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.67 -61.6 2.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.869 0.366 . . . . 0.0 110.296 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -57.43 -37.17 72.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.251 179.756 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.12 41.86 0.46 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.915 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.485 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 8.9 t70 -167.3 -19.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.42 -179.923 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.485 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 34.9 p-80 40.71 93.01 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.252 179.922 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.473 179.855 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -168.13 22.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.824 0.345 . . . . 0.0 110.507 -179.985 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -51.7 -22.55 3.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.488 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -159.51 63.9 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.248 -179.975 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 52.49 -171.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.328 -179.864 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.479 ' CD ' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -75.6 95.03 3.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.784 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.483 ' C ' ' H ' ' A' ' 9' ' ' ARG . 59.8 t-105 -161.91 -14.13 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.541 -179.99 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.503 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -67.62 4.1 1.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.146 -179.864 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.483 ' H ' ' C ' ' A' ' 7' ' ' TRP . 31.0 mmt180 59.58 32.95 21.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.08 -179.873 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.8 ptm180 -48.36 -91.55 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.318 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.5 pt -95.66 -7.2 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.747 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.2 -35.55 88.22 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 179.644 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -53.44 -14.59 0.82 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.07 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -99.63 -43.23 2.53 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.303 -179.816 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 m -108.74 -41.13 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 116.86 0.33 . . . . 0.0 111.29 -179.475 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' C ' ' H ' ' A' ' 18' ' ' ILE . 35.8 ttpt -62.32 -31.71 72.36 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.372 -179.722 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.1 tt -62.76 -1.59 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.057 0.456 . . . . 0.0 110.084 179.497 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.512 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.6 mt 64.26 69.52 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.341 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.413 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -77.63 -16.07 80.62 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.905 179.878 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.494 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 75.57 -11.61 9.51 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.277 -0.487 . . . . 0.0 111.992 -179.975 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.413 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -76.24 17.73 0.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 179.873 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.15 -49.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.28 -179.994 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.8 mt -79.51 66.65 5.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.41 179.854 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -170.46 -26.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -61.87 -77.39 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.729 -179.943 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.448 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.133 -179.883 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 mtt-85 -67.63 85.53 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.781 0.324 . . . . 0.0 110.562 -179.947 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.438 ' C ' ' H ' ' A' ' 5' ' ' ARG . 66.8 mtp85 50.23 -113.44 0.66 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 179.963 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 6' ' ' LYS . 46.1 mttm -80.65 36.59 0.39 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.727 0.299 . . . . 0.0 110.508 179.947 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 3' ' ' ARG . 81.2 mtm180 54.05 -84.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.476 -179.897 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 4' ' ' LYS . 85.2 mttt -143.13 82.41 1.75 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.262 179.967 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 62.1 t-105 -162.65 -0.67 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.506 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.485 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -62.51 -90.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.62 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.29 23.18 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.502 179.607 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -45.46 -90.29 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.022 179.522 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 tp -76.06 -19.02 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.18 -42.25 95.18 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.232 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -46.33 -17.98 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.077 0.465 . . . . 0.0 110.243 179.005 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.467 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.13 -40.76 3.66 Favored Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.198 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -109.56 -44.21 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 116.771 0.285 . . . . 0.0 111.196 -179.62 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.6 ttmt -51.5 -41.74 61.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.719 -179.75 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.0 pt -39.81 -39.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.14 -179.86 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.44 ' CG2' ' N ' ' A' ' 19' ' ' GLY . 16.8 tt -171.82 -47.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.781 179.656 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.44 ' N ' ' CG2' ' A' ' 18' ' ' ILE . . . 154.96 37.85 0.02 OUTLIER Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.899 -0.48 . . . . 0.0 111.899 179.976 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.17 -139.72 21.45 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.402 -0.428 . . . . 0.0 112.112 179.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.74 94.34 9.09 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.57 0.224 . . . . 0.0 111.152 -179.277 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.422 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . 57.87 62.22 2.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -178.83 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.439 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 8.9 mp 56.32 15.65 2.04 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 -177.16 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 22' ' ' ALA . 20.3 t70 49.57 43.21 23.9 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 122.264 1.03 . . . . 0.0 108.949 -179.111 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -79.34 112.31 16.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.561 -1.654 . . . . 0.0 110.385 -179.651 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.476 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 7.9 mp . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.119 179.897 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.402 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.242 0 N-CA-C 111.985 -0.446 . . . . 0.0 111.985 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -70.29 2.05 4.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.804 0.335 . . . . 0.0 110.633 180.0 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.402 ' H ' ' C ' ' A' ' 1' ' ' GLY . 77.4 mtp180 -49.69 -28.58 6.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.512 179.912 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -148.39 154.78 40.38 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.22 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.9 mtp85 -60.27 -76.12 0.05 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.522 179.958 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 48.8 mtmt -136.24 61.34 1.65 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.093 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 97.5 m95 -159.34 4.76 0.09 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.331 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.516 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -51.93 -90.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.439 -179.701 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.516 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 2.5 mmt-85 -147.41 16.52 1.16 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.301 -179.688 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.448 ' CZ ' ' O ' ' A' ' 6' ' ' LYS . 5.8 ptt180 -49.27 -86.63 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.764 179.849 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.416 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 19.4 tt -95.55 -14.5 7.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.233 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.506 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.93 -38.34 74.31 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.652 179.673 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -51.5 -18.7 1.16 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.25 0.548 . . . . 0.0 109.587 179.034 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.417 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.7 -43.4 3.38 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.532 -179.77 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -107.54 -42.53 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.997 0.399 . . . . 0.0 111.299 -179.469 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.523 ' C ' ' H ' ' A' ' 18' ' ' ILE . 1.6 ttpm? -58.01 -34.37 69.94 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.4 -179.953 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.2 tt -64.34 0.29 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 121.118 0.485 . . . . 0.0 109.93 179.519 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.523 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 63.19 96.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.503 -179.991 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.93 6.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.288 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . 179.67 -139.69 3.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.148 -0.549 . . . . 0.0 111.748 -179.966 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.33 -90.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.743 0.306 . . . . 0.0 110.537 179.935 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -69.56 -41.4 75.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.481 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tp -78.91 66.38 4.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.325 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.484 ' C ' ' H ' ' A' ' 26' ' ' LEU . 12.7 t70 -167.31 -4.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.444 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.69 ' HD1' ' H ' ' A' ' 25' ' ' HIS . 9.2 p-80 -71.67 9.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.689 -179.851 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.484 ' H ' ' C ' ' A' ' 24' ' ' ASP . 8.0 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.128 179.852 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.258 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -166.76 51.57 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -60.07 -55.97 27.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.478 179.945 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -82.89 37.05 0.52 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.594 179.963 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 41.2 mtt-85 52.42 -92.6 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.641 179.886 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -146.97 46.67 1.17 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.191 -179.949 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' C ' ' H ' ' A' ' 9' ' ' ARG . 84.7 t90 -122.48 -3.44 8.86 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.602 179.707 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 14.58 0.92 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.181 179.626 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.479 ' NH2' ' HZ3' ' A' ' 16' ' ' LYS . 22.8 mmt180 62.83 42.94 7.39 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.352 179.326 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -52.51 -91.91 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.79 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.3 pp -89.35 -4.58 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.755 178.823 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.552 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -65.67 -38.39 94.51 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 179.618 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -51.4 -16.79 0.62 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.037 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.81 -39.78 4.28 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.378 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.9 m -114.19 -41.72 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 120.795 0.331 . . . . 0.0 111.207 -179.461 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' A' ' 12' ' ' GLY . 79.4 tttt -66.42 -26.47 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.139 -179.722 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 tp -40.95 -42.14 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.278 -179.537 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.404 ' H ' ' H ' ' A' ' 19' ' ' GLY . 9.2 tt -170.87 6.63 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.915 0.388 . . . . 0.0 110.613 179.725 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.404 ' H ' ' H ' ' A' ' 18' ' ' ILE . . . -46.76 -22.9 1.26 Allowed Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.239 -179.998 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.62 -51.3 3.36 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.307 -0.473 . . . . 0.0 111.946 -179.912 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.3 -56.67 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.852 0.358 . . . . 0.0 110.429 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.435 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -66.01 -23.48 66.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.298 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.9 tp -54.26 -11.35 0.48 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.324 179.939 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 22' ' ' ALA . 29.8 t70 -155.17 8.87 0.29 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.599 -179.95 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.432 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 4.8 m80 52.96 103.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.69 179.826 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.958 179.88 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.911 -0.476 . . . . 0.0 111.911 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' H ' ' H ' ' A' ' 3' ' ' ARG . 51.6 ttp85 -169.67 -1.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.933 0.397 . . . . 0.0 110.365 179.986 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.415 ' H ' ' H ' ' A' ' 2' ' ' ARG . 25.7 ttm180 -48.02 -24.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.504 179.794 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -143.34 159.05 43.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.755 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 11.3 tpp85 -73.66 72.27 1.45 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mttm 57.03 60.55 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' CD1' ' O ' ' A' ' 5' ' ' ARG . 85.9 m95 -150.5 12.22 0.71 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.504 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.43 59.54 5.24 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.095 179.979 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 52.96 37.02 23.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.788 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -52.41 -85.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.072 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.4 tt -90.6 -13.46 9.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.162 179.167 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.536 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.71 -42.69 85.77 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.141 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.37 -17.97 0.33 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.786 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.452 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -92.32 -44.03 4.16 Favored Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.716 179.779 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -110.15 -46.45 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.67 0.235 . . . . 0.0 110.997 -179.88 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.608 ' C ' ' H ' ' A' ' 18' ' ' ILE . 33.7 ttmt -52.34 -29.19 22.43 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.0 tp -69.85 27.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.808 0.337 . . . . 0.0 110.519 179.232 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.608 ' H ' ' C ' ' A' ' 16' ' ' LYS . 35.4 pt 37.69 48.82 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.33 -179.778 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.5 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -79.02 38.36 1.98 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.929 179.769 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.408 ' H ' ' C ' ' A' ' 18' ' ' ILE . . . 75.67 -21.81 1.92 Allowed Glycine 0 C--N 1.33 0.223 0 C-N-CA 121.144 -0.55 . . . . 0.0 111.863 -179.93 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.5 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -65.91 -50.97 62.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.768 0.318 . . . . 0.0 110.381 179.978 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.456 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -75.49 -36.93 60.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.49 -179.96 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 tp -76.89 41.51 0.28 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.392 -179.908 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.456 ' H ' ' C ' ' A' ' 22' ' ' ALA . 34.3 t70 -170.89 -23.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.567 -179.948 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 51.3 73.02 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.55 179.972 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.6 tt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.136 179.99 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 N-CA-C 111.943 -0.463 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -170.25 113.65 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.873 0.368 . . . . 0.0 110.247 179.937 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.428 ' C ' ' H ' ' A' ' 5' ' ' ARG . 65.5 mtt85 52.08 -105.87 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.384 -179.916 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' O ' ' N ' ' A' ' 6' ' ' LYS . 79.1 mttt -80.73 38.71 0.45 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.763 0.316 . . . . 0.0 110.543 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.498 HH21 ' HZ3' ' A' ' 6' ' ' LYS . 84.4 mtm180 57.29 -78.63 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.011 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -157.18 74.54 0.78 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.893 0.378 . . . . 0.0 110.209 -179.845 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.429 ' CD2' ' O ' ' A' ' 7' ' ' TRP . 61.4 t90 -167.49 14.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.522 179.836 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.548 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -64.8 -94.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.165 179.844 . . . . . . . . 3 3 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.548 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 63.2 mmt-85 -135.12 11.95 3.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.402 -179.772 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.416 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 4.5 ptm180 -42.25 -87.53 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.633 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.416 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.9 tp -80.32 -17.88 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.968 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.8 -37.42 84.09 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.313 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -52.6 -13.53 0.4 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.176 0.512 . . . . 0.0 109.683 179.209 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.04 -41.22 2.89 Favored Glycine 0 C--N 1.334 0.461 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.125 179.927 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.31 -43.57 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-N 116.61 0.205 . . . . 0.0 111.404 -179.423 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . 45.3 mtpt -65.95 -25.18 67.0 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.505 -179.882 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.519 ' CG2' ' H ' ' A' ' 18' ' ' ILE . 13.6 tt -47.38 -60.47 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.932 -179.76 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.519 ' H ' ' CG2' ' A' ' 17' ' ' ILE . 10.6 tt -171.71 24.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.392 0.615 . . . . 0.0 109.703 179.928 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.437 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -40.29 94.77 0.01 OUTLIER Glycine 0 C--N 1.332 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.475 -179.943 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . -43.12 -21.11 0.11 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 121.354 -0.45 . . . . 0.0 112.21 179.998 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.437 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -69.98 -52.83 21.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.86 0.362 . . . . 0.0 110.25 179.819 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.36 64.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.385 179.806 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.4 tp -50.0 -23.34 1.98 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.433 179.919 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -163.64 64.98 0.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.501 179.831 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 29.5 p80 -69.18 159.85 32.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.614 -179.912 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.457 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.112 179.973 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.497 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.224 0 N-CA-C 111.916 -0.473 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.3 ttt180 64.68 -1.92 0.73 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.812 0.339 . . . . 0.0 110.514 -179.99 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.497 ' H ' ' C ' ' A' ' 1' ' ' GLY . 9.1 tpm_? -51.32 -22.55 2.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.117 0.484 . . . . 0.0 109.778 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -144.46 175.88 9.79 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.793 179.468 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -70.96 -71.41 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.806 -179.693 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -144.89 73.82 1.38 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.326 -179.778 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.403 ' H ' ' H ' ' A' ' 8' ' ' LEU . 69.4 t-105 -170.88 6.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.233 -179.97 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.507 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.87 -75.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.185 -179.814 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' N ' ' CD ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.55 14.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.292 179.382 . . . . . . . . 3 3 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 2.1 ptp180 -41.91 -87.09 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.48 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.424 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 14.8 tt -79.12 -10.7 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.934 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.51 -44.2 97.98 Favored Glycine 0 C--N 1.336 0.582 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.556 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -46.92 -17.91 0.06 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.092 0.472 . . . . 0.0 109.846 178.54 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.47 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.34 -44.47 2.55 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.498 -179.993 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.88 -42.01 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 117.005 0.403 . . . . 0.0 110.879 -179.566 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 17.4 ttmm -61.94 -32.75 73.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.759 0.314 . . . . 0.0 110.443 -179.97 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.447 ' CG2' ' N ' ' A' ' 18' ' ' ILE . 8.8 tt -60.21 -45.8 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.447 ' N ' ' CG2' ' A' ' 17' ' ' ILE . 76.2 mt -138.87 -65.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.414 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.12 7.61 Favored Glycine 0 C--N 1.33 0.236 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.033 -179.967 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . 164.99 168.62 27.43 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 121.343 -0.456 . . . . 0.0 111.984 179.987 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.7 -88.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.707 0.289 . . . . 0.0 110.522 -179.959 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -57.2 -21.75 35.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.306 179.928 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.85 -17.91 7.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.051 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' A' ' 26' ' ' LEU . 47.8 t0 -154.28 61.75 0.7 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.514 -179.985 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -77.13 34.25 0.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.555 179.826 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.486 ' H ' ' C ' ' A' ' 24' ' ' ASP . 12.1 mt . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.545 -179.815 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.45 -35.81 70.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.789 0.328 . . . . 0.0 110.542 179.912 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 47.48 -97.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.734 -179.992 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' O ' ' O ' ' A' ' 5' ' ' ARG . 62.5 mttt -97.98 36.58 1.53 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.277 179.97 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 7' ' ' TRP . 77.1 mtp180 56.15 162.05 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.187 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' O ' ' CD2' ' A' ' 7' ' ' TRP . 1.4 mptm? -49.0 87.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.745 0.307 . . . . 0.0 110.656 -179.408 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.527 ' N ' ' O ' ' A' ' 5' ' ' ARG . 0.4 OUTLIER -172.34 -18.43 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.105 179.839 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.415 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -49.77 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.241 179.875 . . . . . . . . 3 3 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.415 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 1.9 ppt_? -172.5 21.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.106 -179.861 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.6 ptt85 -43.81 -90.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.495 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.5 tt -83.65 -14.45 11.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.2 -42.25 81.42 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.536 -0.625 . . . . 0.0 111.536 179.672 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -47.39 -16.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 110.137 179.064 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.461 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.9 -42.54 2.43 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.644 -179.844 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -104.91 -41.16 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 117.093 0.446 . . . . 0.0 111.077 -179.456 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.495 ' C ' ' H ' ' A' ' 18' ' ' ILE . 62.1 tttm -54.41 -53.0 59.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 110.716 -179.721 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -73.81 13.02 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 120.998 0.427 . . . . 0.0 110.211 -179.852 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.495 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.3 mt 59.21 104.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.372 -179.907 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.37 139.83 26.36 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.191 -179.813 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 50.4 15.48 1.19 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.126 179.796 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 49.92 16.2 0.21 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.34 -179.786 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -158.39 -29.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.898 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.9 tp -80.16 53.91 1.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.968 179.622 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -163.72 -32.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.274 -179.62 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -78.92 102.91 8.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.549 179.984 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.491 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.1 mp . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.14 179.932 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 111.981 -0.448 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -169.48 89.22 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.751 0.31 . . . . 0.0 110.542 -179.988 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -97.06 -27.69 14.48 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.72 -179.94 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.517 ' O ' ' N ' ' A' ' 6' ' ' LYS . 57.5 mttt -143.87 45.38 1.47 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.379 -179.729 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 57.74 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.605 -179.819 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' C ' ' H ' ' A' ' 8' ' ' LEU . 76.8 mttt -137.04 -167.19 2.04 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 179.736 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' C ' ' H ' ' A' ' 9' ' ' ARG . 1.1 m-90 72.8 -30.18 0.21 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.14 -179.975 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.52 ' H ' ' C ' ' A' ' 6' ' ' LYS . 0.3 OUTLIER -68.36 9.67 0.31 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.261 -179.644 . . . . . . . . 3 3 . 1 . 041 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.4 mmt85 60.24 61.7 1.75 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.714 0.292 . . . . 0.0 111.014 179.426 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 25.1 ptt180 -59.27 -50.12 75.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.253 0.549 . . . . 0.0 109.847 179.402 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.47 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 12.4 tt -124.75 -19.17 3.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 178.872 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -55.99 -33.59 60.75 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.281 179.276 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -54.21 -11.61 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.173 0.511 . . . . 0.0 109.747 179.371 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.491 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -105.69 -44.04 1.48 Allowed Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.445 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.423 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.1 m -102.41 -38.65 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.944 0.372 . . . . 0.0 111.61 -179.207 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 12' ' ' GLY . 66.8 mttm -73.91 -27.61 61.13 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.732 -179.775 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.5 tt -43.49 -37.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 121.151 -0.22 . . . . 0.0 111.473 -179.613 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 3.1 tp -164.51 17.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 120.922 0.391 . . . . 0.0 110.498 179.979 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -122.92 16.82 8.21 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.666 -0.574 . . . . 0.0 111.666 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.484 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -167.42 -38.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.145 -0.55 . . . . 0.0 111.825 179.953 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.41 1.8 2.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.888 0.375 . . . . 0.0 110.303 179.899 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.484 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -156.21 -43.77 0.08 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.076 179.961 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.5 mm? -79.85 61.21 3.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.814 179.769 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -162.86 -37.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.521 -179.86 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -73.18 -92.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.492 -179.974 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.5 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 7.7 mp . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.132 -179.932 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.517 ' N ' ' NH1' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.263 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.48 HH22 ' NH2' ' A' ' 10' ' ' ARG . 88.5 mtt-85 -147.08 86.5 1.64 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.803 0.335 . . . . 0.0 110.405 179.976 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.556 ' H ' ' NE ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -67.01 -74.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.965 179.764 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -76.17 -82.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.432 179.921 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.436 ' NE ' ' HZ1' ' A' ' 6' ' ' LYS . 19.3 ttt85 -169.54 -71.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.504 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 38.0 mttp -145.85 55.77 1.19 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.104 179.612 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 8.7 m-90 -160.45 6.02 0.08 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.269 -179.832 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.469 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.87 -88.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.982 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -171.03 23.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.514 179.563 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.48 ' NH2' HH22 ' A' ' 2' ' ' ARG . 0.3 OUTLIER -43.6 -90.07 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.04 179.658 . . . . . . . . 3 3 . 1 . 042 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.4 pp -98.19 1.32 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.113 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -70.11 -32.77 69.24 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 178.91 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -50.15 -14.91 0.18 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.048 0.451 . . . . 0.0 109.918 178.78 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -105.55 -45.45 1.32 Allowed Glycine 0 C--N 1.337 0.59 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.521 -179.6 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.3 m -99.99 -38.31 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 117.058 0.429 . . . . 0.0 111.224 -179.344 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.475 ' N ' ' O ' ' A' ' 12' ' ' GLY . 46.9 tttm -66.4 -42.78 87.33 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 -179.712 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.5 tt -47.95 -20.45 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.645 -179.687 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -135.03 2.5 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.365 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -91.95 -24.43 25.11 Favored Glycine 0 C--N 1.331 0.258 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.825 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.497 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -167.06 -168.01 28.6 Favored Glycine 0 N--CA 1.451 -0.36 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 179.914 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.32 11.53 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.55 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -169.04 -52.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.315 -179.9 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -81.76 57.29 3.34 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.906 0.384 . . . . 0.0 110.443 179.834 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.497 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 34.3 m-20 -162.35 -58.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.018 -179.947 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.497 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 57.0 p-80 40.94 28.7 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.223 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.479 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.107 -179.911 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 2' ' ' ARG . 10.2 mpt_? -72.71 73.67 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.369 . . . . 0.0 110.202 179.926 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -70.2 -38.29 75.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.596 -179.878 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mtpt -145.25 44.6 1.32 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.461 -179.918 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 55.22 34.65 23.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.499 179.92 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 54.03 80.73 0.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.638 179.997 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' C ' ' H ' ' A' ' 9' ' ' ARG . 25.4 t90 -166.29 10.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.111 179.905 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.58 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.7 pt? -75.84 23.87 0.13 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.069 -179.86 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.492 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.4 mmt85 62.21 38.59 13.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.43 179.912 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -46.5 -92.71 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.461 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.461 ' CD1' ' H ' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -85.21 -1.06 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.761 . . . . . . . . 3 3 . 1 . 043 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -69.94 -44.84 60.05 Favored Glycine 0 C--N 1.336 0.566 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.766 -179.894 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -45.54 -17.44 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.268 0.556 . . . . 0.0 110.129 178.938 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -94.78 -45.03 3.24 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.031 -179.935 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.48 ' O ' ' N ' ' A' ' 19' ' ' GLY . 25.8 m -108.83 -40.92 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 120.763 0.316 . . . . 0.0 110.564 -179.965 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.556 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.9 tptm -66.1 -41.11 91.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.884 179.824 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.0 tt -41.07 -25.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.4 -179.616 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.463 ' CG2' ' N ' ' A' ' 19' ' ' GLY . 15.0 tt -164.83 -48.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.942 179.451 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 164.62 -15.79 0.1 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.024 179.965 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.64 -32.38 1.21 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 121.148 -0.549 . . . . 0.0 111.911 -179.946 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.491 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -50.49 -51.97 42.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.834 0.349 . . . . 0.0 110.432 179.864 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.66 -40.12 61.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.355 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -61.27 -14.59 27.47 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.84 -179.988 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.457 ' C ' ' H ' ' A' ' 26' ' ' LEU . 19.1 t70 -162.83 62.87 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 -179.994 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -72.87 8.96 1.28 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.65 -179.886 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.457 ' H ' ' C ' ' A' ' 24' ' ' ASP . 31.3 mt . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.329 179.827 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.937 -0.465 . . . . 0.0 111.937 . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -75.15 72.3 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.801 0.334 . . . . 0.0 110.458 -179.975 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.5 mmt85 -73.39 -21.2 60.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.341 -179.956 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 6' ' ' LYS . 42.9 mttp -146.02 42.52 1.22 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.118 179.934 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 53.84 -88.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.522 -179.899 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.636 ' HZ2' ' NH2' ' A' ' 10' ' ' ARG . 50.5 mttm -146.38 59.11 1.22 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.506 -179.931 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -126.87 -4.66 6.35 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.872 179.649 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -86.61 10.47 15.44 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.142 179.658 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 59.78 48.55 9.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.065 179.515 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.636 ' NH2' ' HZ2' ' A' ' 6' ' ' LYS . 1.3 ptp180 -51.38 -76.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.86 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.448 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 14.1 tt -98.42 -13.71 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.424 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.484 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -54.62 -43.81 78.95 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.459 179.728 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -47.82 -16.83 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.177 0.513 . . . . 0.0 109.998 179.153 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -97.76 -41.81 3.26 Favored Glycine 0 C--N 1.334 0.47 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.258 179.946 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.1 m -106.05 -44.75 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 117.048 0.424 . . . . 0.0 111.32 -179.534 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.523 ' C ' ' H ' ' A' ' 18' ' ' ILE . 32.6 mmtm -58.11 -33.53 69.23 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.838 179.926 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.9 tt -61.13 -2.25 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.162 179.498 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.523 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.1 mt 64.98 88.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.325 -179.851 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.46 29.28 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.967 -179.942 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -176.86 -152.57 9.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.054 -179.921 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.44 -91.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.776 0.322 . . . . 0.0 110.233 -179.805 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -74.89 -39.07 61.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.265 179.681 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.472 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 8.7 mp -78.49 72.33 5.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.998 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -170.45 -24.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.541 -179.965 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -78.22 47.02 0.65 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.504 -179.955 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.443 179.934 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.615 ' H2 ' ' NH2' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.222 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.615 ' NH2' ' H2 ' ' A' ' 1' ' ' GLY . 7.1 ptp85 -166.14 -8.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.75 0.31 . . . . 0.0 110.475 179.983 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.513 ' C ' ' H ' ' A' ' 5' ' ' ARG . 17.9 mmm180 -53.73 94.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.731 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' CD ' ' N ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER 55.85 6.86 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.419 -179.527 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 3' ' ' ARG . 12.7 tpt85 -87.59 81.72 7.65 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.404 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt 57.03 55.92 5.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.253 -179.45 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 71.4 t-105 -164.29 1.94 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.175 -179.858 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.442 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.14 -79.64 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 -179.583 . . . . . . . . 3 3 . 1 . 045 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 mmt85 -151.07 17.96 0.76 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.777 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.405 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 8.3 ptt85 -41.33 -88.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.456 -179.815 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.405 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 18.7 tt -82.58 -16.82 11.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.277 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.61 -41.26 93.53 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.301 179.659 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -50.75 -18.06 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 109.359 178.717 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.13 -44.3 3.58 Favored Glycine 0 C--N 1.335 0.516 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.456 179.898 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.1 m -104.31 -44.03 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 116.998 0.399 . . . . 0.0 110.869 -179.63 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' N ' ' O ' ' A' ' 12' ' ' GLY . 76.9 tttt -58.24 -32.54 68.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.792 0.329 . . . . 0.0 110.333 179.84 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.3 tt -61.75 -0.86 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.339 179.73 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.523 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 64.36 79.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.281 -179.931 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.83 -2.13 90.64 Favored Glycine 0 C--N 1.332 0.347 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.024 -179.962 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.442 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 175.13 12.01 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.24 -179.991 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 47.85 18.33 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.398 -179.707 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.442 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -156.81 -27.91 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.252 179.762 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.8 tp -82.74 57.19 3.68 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.459 179.262 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' C ' ' H ' ' A' ' 26' ' ' LEU . 25.4 p-10 -145.53 -12.07 0.52 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.577 -179.216 . . . . . . . . 2 2 . 1 . 045 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -81.53 30.1 0.36 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.772 -179.934 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.482 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.069 -179.987 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.021 -0.431 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -75.22 119.79 19.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.774 0.321 . . . . 0.0 110.524 179.999 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -166.36 -17.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.909 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -138.9 37.88 2.16 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.328 179.988 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.403 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER 49.94 44.12 25.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.525 179.903 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 54.9 mttm 55.01 77.42 0.21 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.045 179.614 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 79.1 m95 -162.57 12.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.699 179.556 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.514 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -59.98 -91.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.162 179.974 . . . . . . . . 3 3 . 1 . 046 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 22.9 mmt180 -143.31 15.38 1.85 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.708 -179.632 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -45.35 -87.0 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.883 179.789 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 pt -93.43 -10.23 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.839 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.07 -34.25 65.89 Favored Glycine 0 N--CA 1.45 -0.412 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 179.756 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.9 ttpp -50.08 -16.41 0.3 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.037 0.446 . . . . 0.0 109.968 179.178 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.66 -44.36 1.56 Allowed Glycine 0 C--N 1.335 0.488 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.667 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.9 m -102.65 -37.82 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-N 116.971 0.386 . . . . 0.0 111.307 -179.336 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' N ' ' O ' ' A' ' 12' ' ' GLY . 83.7 tttt -71.35 -34.99 70.99 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.9 -179.644 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.2 tt -50.82 -36.66 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.457 -179.712 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.79 -64.75 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.616 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 168.44 -12.41 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.452 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.14 -60.55 3.1 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.356 -0.449 . . . . 0.0 112.129 179.907 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.89 -47.14 60.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.86 0.362 . . . . 0.0 110.726 -179.877 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.87 -7.23 57.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.801 -179.829 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.3 tp -138.2 66.69 1.43 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.898 0.38 . . . . 0.0 110.191 179.89 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.481 ' C ' ' H ' ' A' ' 26' ' ' LEU . 28.2 t70 -169.45 -24.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.07 179.965 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -78.46 30.94 0.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.888 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 24' ' ' ASP . 9.8 mp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.112 179.988 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -77.98 71.07 4.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.294 . . . . 0.0 110.651 180.0 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -74.32 -24.89 59.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.47 -179.945 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -142.41 -88.74 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.486 179.982 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.6 mtp85 -155.03 -69.79 0.12 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.741 0.305 . . . . 0.0 110.371 -179.981 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -159.17 49.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.37 -179.805 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.497 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 93.3 m95 -160.09 11.82 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.765 179.924 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.47 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.08 -69.8 0.12 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.122 -179.898 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -166.92 20.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.17 179.913 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -43.0 -89.82 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.755 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.9 pt -89.31 -8.64 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.973 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.94 -41.3 96.21 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 179.977 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -48.6 -16.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.114 0.483 . . . . 0.0 110.008 179.105 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.81 -41.79 2.81 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.488 -179.915 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.2 m -109.0 -41.39 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 116.924 0.362 . . . . 0.0 111.39 -179.284 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.492 ' C ' ' H ' ' A' ' 18' ' ' ILE . 87.7 tttt -54.38 -53.99 46.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.569 -179.592 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.3 tt -70.04 4.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 109.859 179.766 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.492 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.8 mt 60.69 70.54 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.294 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.98 107.23 2.1 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.167 -0.54 . . . . 0.0 112.055 -179.912 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.496 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -57.59 -14.58 14.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.87 179.872 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.28 13.29 0.59 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.351 . . . . 0.0 110.465 179.902 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.496 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -161.44 -46.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.293 179.963 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.49 62.53 3.12 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.231 0.538 . . . . 0.0 109.741 179.872 . . . . . . . . 2 2 . 1 . 047 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -171.87 -53.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.449 -179.795 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -76.84 99.97 5.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.465 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.4 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.051 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.1 mmt85 -73.38 84.24 1.45 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.915 0.388 . . . . 0.0 110.655 -179.933 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.495 ' C ' ' H ' ' A' ' 5' ' ' ARG . 57.4 mtp85 52.06 -93.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.912 179.788 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -76.97 27.41 0.14 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.597 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.495 ' H ' ' C ' ' A' ' 3' ' ' ARG . 23.4 mmt180 51.01 62.02 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.566 179.816 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm 52.1 82.3 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.893 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 28.4 t90 -167.86 8.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.397 -179.94 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.481 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.63 -89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.751 . . . . . . . . 3 3 . 1 . 048 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -166.92 22.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.817 179.548 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.57 -90.05 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.598 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 tt -78.81 -17.14 13.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.009 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.71 -46.18 83.18 Favored Glycine 0 C--O 1.221 -0.658 0 C-N-CA 120.829 -0.701 . . . . 0.0 111.909 179.977 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 43.1 pttt -47.31 -17.77 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.734 -0.862 . . . . 0.0 109.356 178.486 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -86.21 -52.08 3.35 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.819 179.415 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -92.38 -43.07 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.556 ' N ' ' O ' ' A' ' 12' ' ' GLY . 77.7 tttt -53.4 -48.58 68.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.462 179.006 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' CG2' ' O ' ' A' ' 13' ' ' LYS . 9.0 tt -65.15 4.42 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.218 179.849 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.556 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.4 mt 63.78 91.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.345 -179.749 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -157.37 -47.02 0.01 OUTLIER Glycine 0 C--N 1.333 0.364 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.945 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.2 -44.43 8.08 Favored Glycine 0 C--N 1.33 0.242 0 N-CA-C 111.856 -0.498 . . . . 0.0 111.856 179.847 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -44.65 -58.82 2.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.85 0.357 . . . . 0.0 110.992 -179.874 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.09 -45.04 82.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.481 -179.943 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.5 mt -85.91 48.32 1.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.693 -179.971 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -167.32 -38.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.41 179.714 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -61.3 -77.02 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.397 179.728 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.457 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.351 179.807 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -76.17 65.19 2.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.779 0.323 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -77.36 -24.16 50.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.595 -179.956 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -169.94 50.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 -179.916 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.1 mtm180 44.12 -155.24 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 -179.87 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' C ' ' HE ' ' A' ' 10' ' ' ARG . 64.3 mmtt -80.34 78.74 7.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.245 179.591 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.455 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 63.7 t-105 -171.55 3.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.383 -179.831 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.492 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -55.18 -84.59 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.185 -179.523 . . . . . . . . 3 3 . 1 . 049 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 mmm-85 -143.64 17.21 1.82 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 110.556 -0.164 . . . . 0.0 110.556 -179.806 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.496 ' HE ' ' C ' ' A' ' 6' ' ' LYS . 4.6 ptt180 -47.95 -86.63 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.965 179.942 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.1 mm -89.85 -12.05 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.285 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.47 -39.33 90.49 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 179.561 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -53.13 -13.0 0.42 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.841 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -103.51 -44.44 1.69 Allowed Glycine 0 C--N 1.335 0.52 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.143 179.899 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.6 m -102.79 -40.52 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 116.887 0.343 . . . . 0.0 111.311 -179.576 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' C ' ' H ' ' A' ' 18' ' ' ILE . 10.0 ttmm -55.88 -51.78 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.5 -179.83 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.7 tt -67.4 5.7 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 -179.856 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.512 ' H ' ' C ' ' A' ' 16' ' ' LYS . 17.7 mt 61.36 88.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.338 179.944 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.4 89.52 0.92 Allowed Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.958 179.94 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.473 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -56.91 -160.1 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.807 -179.97 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.97 12.5 0.2 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.907 0.384 . . . . 0.0 110.359 -179.92 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.473 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -170.36 -57.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.264 -179.935 . . . . . . . . 2 2 . 1 . 049 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.7 tp -85.83 49.73 1.83 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.329 179.847 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -167.24 -53.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 2.9 t60 52.77 97.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.974 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.47 179.856 . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.253 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 . . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -61.66 92.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.815 0.341 . . . . 0.0 110.659 -179.968 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -61.01 -29.44 69.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.229 179.745 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -167.93 59.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.315 -179.891 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 59.19 -163.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.353 -179.728 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -80.64 87.88 5.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 -179.607 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.528 ' C ' ' H ' ' A' ' 9' ' ' ARG . 45.2 t-105 -166.8 0.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.246 179.832 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.581 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.9 pt? -73.4 29.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.402 -179.768 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.528 ' H ' ' C ' ' A' ' 7' ' ' TRP . 41.1 mmm-85 62.85 40.58 9.55 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.854 0.359 . . . . 0.0 110.568 179.835 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -52.2 -89.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.718 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -76.15 -22.27 15.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.587 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.469 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -54.27 -43.46 75.18 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 179.565 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -46.02 -17.67 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.094 0.474 . . . . 0.0 110.146 178.947 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -98.11 -44.25 2.64 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.36 179.971 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.65 -43.67 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 117.155 0.478 . . . . 0.0 111.299 -179.544 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.488 ' C ' ' H ' ' A' ' 18' ' ' ILE . 19.4 mmtp -61.02 -31.87 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.379 -0.528 . . . . 0.0 109.991 179.868 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.5 tp -65.48 -0.62 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.451 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.488 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.3 mt 62.65 78.17 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.345 -179.722 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 172.12 47.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.796 179.976 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -166.59 -67.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.249 -0.501 . . . . 0.0 111.94 -179.921 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.76 -56.09 24.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.786 0.327 . . . . 0.0 110.36 179.92 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.26 -22.46 63.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.283 179.823 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.66 -25.9 60.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.211 179.925 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -160.65 68.08 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.376 179.984 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.542 ' HD1' ' H ' ' A' ' 25' ' ' HIS . 19.7 p-80 -58.27 153.96 14.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.564 -179.846 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.759 -179.937 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 051 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 51.13 70.17 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.802 0.334 . . . . 0.0 110.583 -180.0 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.655 ' HE ' HH22 ' A' ' 9' ' ' ARG . 67.2 ttp85 -58.93 -29.47 67.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.536 -179.982 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -165.81 70.87 0.14 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.655 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 51.16 -108.74 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 179.708 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 97.4 mttt -146.04 72.48 1.3 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.731 0.301 . . . . 0.0 110.49 -179.794 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 4.1 m-90 -162.22 9.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.87 179.815 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.424 ' CD2' ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -78.01 -89.73 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.747 179.831 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.655 HH22 ' HE ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -171.73 23.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.583 179.818 . . . . . . . . 3 3 . 1 . 051 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -44.26 -90.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.134 179.618 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.8 mm -81.7 -14.73 12.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.395 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.511 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.81 -41.96 96.28 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.443 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -50.77 -15.07 0.24 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.308 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.65 -45.81 1.89 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.229 179.931 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -101.68 -41.42 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.993 0.397 . . . . 0.0 110.998 -179.683 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.511 ' N ' ' O ' ' A' ' 12' ' ' GLY . 80.5 tttt -57.65 -40.25 78.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.759 0.314 . . . . 0.0 110.374 179.941 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -67.34 2.41 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.071 0.462 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.475 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.6 mt 60.33 72.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.41 -179.891 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.436 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -75.41 11.41 9.26 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.263 -0.494 . . . . 0.0 112.05 -179.969 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.408 ' H ' ' C ' ' A' ' 18' ' ' ILE . . . 76.9 -39.31 1.57 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.012 179.948 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.436 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -58.89 -46.44 87.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.85 0.357 . . . . 0.0 110.468 -179.939 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.445 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -70.02 -26.17 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.409 179.931 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 tp -77.06 40.98 0.27 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.4 -179.902 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.445 ' H ' ' C ' ' A' ' 22' ' ' ALA . 23.9 t0 -167.62 -28.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.677 -179.891 . . . . . . . . 2 2 . 1 . 051 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 83.2 t60 55.34 90.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 179.991 . . . . . . . . 1 1 . 1 . 051 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.482 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.118 -179.982 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 052 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 mmt-85 -71.53 75.54 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.519 179.971 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.5 ttp85 -68.61 -15.7 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.321 179.842 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -155.5 -89.94 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.391 179.99 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -171.97 71.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.818 0.342 . . . . 0.0 110.39 179.985 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.0 mttt 52.61 61.51 3.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.435 -179.954 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' C ' ' H ' ' A' ' 9' ' ' ARG . 77.5 t90 -162.74 -10.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.961 179.928 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.582 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 2.0 pt? -63.18 3.63 0.26 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.482 -179.841 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.495 ' H ' ' C ' ' A' ' 7' ' ' TRP . 19.0 mmt180 62.11 40.05 12.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.723 0.297 . . . . 0.0 110.774 179.982 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -50.56 -92.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.174 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.4 pp -93.02 1.97 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.834 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -71.3 -37.38 63.15 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.702 -0.959 . . . . 0.0 110.702 179.27 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -51.17 -15.61 0.38 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.73 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.447 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -97.35 -41.92 3.33 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.434 -179.779 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.6 m -110.95 -41.57 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.872 0.336 . . . . 0.0 111.096 -179.472 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 36.7 ttmt -59.45 -32.65 70.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.8 tp -70.45 7.33 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.129 179.882 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.506 ' H ' ' C ' ' A' ' 16' ' ' LYS . 18.6 mt 59.3 93.66 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.131 -179.651 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.12 -2.29 0.04 OUTLIER Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.281 -0.485 . . . . 0.0 111.9 -179.98 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -172.42 173.72 45.4 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.154 -0.546 . . . . 0.0 111.822 179.916 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.52 10.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.893 0.378 . . . . 0.0 110.267 -179.803 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.481 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -169.54 0.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.398 -179.96 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.424 ' H ' ' H ' ' A' ' 22' ' ' ALA . 7.3 tp -153.38 49.18 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.384 179.923 . . . . . . . . 2 2 . 1 . 052 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -171.54 10.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.528 179.959 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -62.55 140.18 58.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.881 . . . . . . . . 1 1 . 1 . 052 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.505 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.1 mm? . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.095 179.982 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 053 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.608 ' H ' ' NE ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER 52.24 98.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.806 0.336 . . . . 0.0 110.181 -179.954 . . . . . . . . 3 3 . 1 . 053 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -61.17 -24.34 66.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.633 -179.978 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -167.31 50.66 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 -179.885 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 69.3 -153.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.905 -179.902 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.49 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 52.4 mmtt -88.14 66.67 8.61 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.791 0.329 . . . . 0.0 110.679 179.944 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 85.9 m95 -155.83 6.15 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.854 179.705 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.522 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.5 pt? -74.79 18.34 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 -179.94 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.49 ' H ' ' C ' ' A' ' 7' ' ' TRP . 14.6 mmt85 63.19 42.33 7.21 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.022 179.752 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 2.6 ptp180 -52.67 -91.46 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.648 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.415 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 18.8 tt -82.1 -16.14 11.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.47 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.09 -40.37 82.85 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.552 179.767 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -49.2 -15.71 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.001 179.058 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.482 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -101.02 -43.53 2.21 Favored Glycine 0 C--N 1.336 0.569 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.516 -179.903 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.9 m -104.05 -40.93 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 117.051 0.425 . . . . 0.0 111.041 -179.639 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.501 ' N ' ' O ' ' A' ' 12' ' ' GLY . 17.6 tptp -59.98 -40.45 89.17 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.563 -179.839 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.3 tt -53.94 -38.86 38.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.285 179.901 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.7 mt -75.94 -69.63 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.186 179.629 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -176.97 50.74 0.11 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 111.514 -0.634 . . . . 0.0 111.514 -179.991 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.09 -22.24 0.11 Allowed Glycine 0 C--N 1.331 0.294 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.474 -179.793 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.427 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -55.8 -68.74 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.819 0.343 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.26 -42.87 22.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.32 179.873 . . . . . . . . 1 1 . 1 . 053 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.39 75.89 1.9 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.228 0.537 . . . . 0.0 109.714 179.952 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' A' ' 25' ' ' HIS . 38.4 p-10 -173.34 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.945 -179.763 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.43 ' N ' ' OD1' ' A' ' 24' ' ' ASP . 84.5 t60 -56.78 103.2 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.523 179.939 . . . . . . . . 2 2 . 1 . 053 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.323 -179.956 . . . . . . . . 0 0 . 1 . 054 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 4' ' ' LYS . 65.7 mtt-85 58.68 -77.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.654 0.264 . . . . 0.0 110.878 179.92 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 1' ' ' GLY . 98.7 mtt180 54.26 -88.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 6' ' ' LYS . 12.1 mptt -76.71 17.17 0.43 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.263 179.933 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.48 ' H ' ' C ' ' A' ' 3' ' ' ARG . 76.2 mtm180 58.2 -78.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.717 -179.838 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.9 mttm -145.32 65.05 1.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.784 0.326 . . . . 0.0 110.519 -179.907 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.423 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 54.1 t-105 -171.0 21.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.384 179.793 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.434 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -74.9 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.09 179.95 . . . . . . . . 3 3 . 1 . 054 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.434 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 3.2 tpt180 -153.57 16.86 0.53 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.886 -179.872 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.608 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 4.7 ptm180 -46.37 -62.49 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.258 -179.789 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.608 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 10.7 tp -113.57 -16.68 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.556 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.53 -31.42 57.31 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.625 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -53.93 -27.24 29.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.312 0.577 . . . . 0.0 109.703 179.136 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -89.9 -30.2 13.62 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.493 -179.571 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' GLY . 20.4 m -124.4 -48.57 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.285 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 54.6 tttm -48.66 -52.06 25.2 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.174 -179.095 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.8 tt -68.68 -42.36 83.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.142 179.717 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 26.4 mt -134.67 84.19 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.92 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 154.49 -8.86 0.39 Allowed Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.553 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -159.41 -134.79 1.74 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.809 -0.517 . . . . 0.0 111.809 -179.988 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.83 -106.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.388 -179.9 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.4 -40.34 93.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.935 0.398 . . . . 0.0 110.171 179.685 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 9.3 mp -82.94 68.69 9.54 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 054 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -167.65 -40.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -70.64 -82.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.587 -179.838 . . . . . . . . 1 1 . 1 . 054 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.439 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.5 mp . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 055 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.708 ' H ' ' HE ' ' A' ' 2' ' ' ARG . 0.2 OUTLIER -82.79 -176.3 6.22 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 179.967 . . . . . . . . 3 3 . 1 . 055 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 55.9 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 2' ' ' ARG . 56.2 tttp -149.55 59.79 1.01 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 110.085 179.87 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.7 mtt-85 53.05 -109.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.772 179.955 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -146.1 74.23 1.36 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 110.455 -179.918 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.417 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 73.5 t-105 -167.92 2.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.475 179.966 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.528 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -58.53 -91.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.075 179.751 . . . . . . . . 3 3 . 1 . 055 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.528 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 28.3 mmt180 -139.49 13.08 2.55 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.662 -179.81 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.409 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -43.93 -87.61 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.447 . . . . . . . . 3 3 . 1 . 055 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.409 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 2.5 pp -89.96 -9.28 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.34 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.33 -42.22 88.55 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 179.546 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.86 -13.78 0.31 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.949 0.404 . . . . 0.0 109.989 179.435 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -102.0 -31.62 5.3 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.409 -179.681 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.1 m -122.03 -41.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 116.771 0.286 . . . . 0.0 111.328 -179.371 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' A' ' 12' ' ' GLY . 63.5 tttm -55.39 -52.08 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.934 -179.669 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.9 tt -58.48 -42.33 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.719 -179.677 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.402 ' C ' ' H ' ' A' ' 20' ' ' GLY . 6.6 mt -73.91 -20.06 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.049 0.452 . . . . 0.0 110.174 179.757 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.27 -14.79 0.95 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.225 -0.512 . . . . 0.0 112.061 -179.946 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.402 ' H ' ' C ' ' A' ' 18' ' ' ILE . . . 77.09 -45.61 2.3 Favored Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.754 -0.538 . . . . 0.0 111.754 -179.873 . . . . . . . . 2 2 . 1 . 055 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.88 -39.89 66.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.908 0.385 . . . . 0.0 109.986 179.649 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.75 -49.06 15.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.993 179.515 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.5 tp -80.27 62.3 4.37 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.262 179.724 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -165.52 -0.22 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.678 179.976 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -73.63 112.2 9.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.506 -179.987 . . . . . . . . 1 1 . 1 . 055 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.436 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.097 179.984 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 111.946 -0.462 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 056 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.536 HH22 ' HZ1' ' A' ' 6' ' ' LYS . 46.3 mtt-85 -75.06 81.26 2.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 0.0 110.606 179.964 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.15 -36.43 83.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.628 -179.916 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -171.17 67.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.577 179.981 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.3 mmm-85 53.95 175.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.385 179.99 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.536 ' HZ1' HH22 ' A' ' 2' ' ' ARG . 62.2 mmtt -58.95 91.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.551 -179.981 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.447 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 76.1 t-105 -171.1 4.78 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.696 179.866 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.466 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -72.41 -94.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.838 . . . . . . . . 3 3 . 1 . 056 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.95 25.8 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.554 -179.914 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.49 ' NH2' ' HZ2' ' A' ' 6' ' ' LYS . 2.9 ptp180 -44.36 -90.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.513 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.9 pt -81.12 -15.25 12.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.627 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.2 -38.94 91.54 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.472 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ttpp -45.68 -20.56 0.08 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.154 0.502 . . . . 0.0 109.979 178.525 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.07 -46.05 2.71 Favored Glycine 0 C--N 1.336 0.555 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.48 -179.875 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.58 -42.89 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 116.948 0.374 . . . . 0.0 111.04 -179.568 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.3 tttp -58.16 -35.74 71.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.715 0.293 . . . . 0.0 110.608 179.965 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.37 0.76 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.017 0.437 . . . . 0.0 110.393 179.998 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.51 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.1 mt 62.84 76.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.469 179.897 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.481 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -85.64 34.95 3.25 Favored Glycine 0 C--N 1.332 0.322 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.941 179.94 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.2 -35.1 1.1 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.25 -0.5 . . . . 0.0 111.879 -179.938 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.481 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -58.31 -52.65 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 0.0 110.435 179.989 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.75 -31.41 71.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.342 179.79 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.64 72.39 1.02 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.229 0.538 . . . . 0.0 109.63 179.818 . . . . . . . . 2 2 . 1 . 056 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -172.23 -9.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.057 -179.728 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.6 p-80 -49.13 134.39 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.733 -179.893 . . . . . . . . 1 1 . 1 . 056 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.5 mt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.476 179.923 . . . . . . . . 0 0 . 1 . 057 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.439 ' H1 ' ' H ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.439 ' H ' ' H1 ' ' A' ' 1' ' ' GLY . 98.6 mtt180 -73.2 111.71 8.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.449 -179.991 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -71.2 -58.11 3.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 -179.916 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -141.21 36.38 1.71 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.165 -179.928 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 53.57 -164.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.058 -179.599 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -78.75 69.85 4.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.463 179.838 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.435 ' HE1' ' NZ ' ' A' ' 16' ' ' LYS . 50.5 t-105 -167.06 6.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.841 -179.854 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.467 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.02 -80.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.339 -179.903 . . . . . . . . 3 3 . 1 . 057 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.5 mmt85 -147.67 14.84 1.09 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.965 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 1.0 OUTLIER -46.34 -87.34 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.135 179.679 . . . . . . . . 3 3 . 1 . 057 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.401 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 17.5 tt -82.67 -20.24 9.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.054 179.423 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.46 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -53.55 -39.33 60.13 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.353 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -45.27 -19.37 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 0.0 110.292 178.974 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.2 -44.98 2.1 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.758 -179.545 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.4 m -99.57 -40.62 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 117.395 0.598 . . . . 0.0 111.676 -179.223 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.435 ' NZ ' ' HE1' ' A' ' 7' ' ' TRP . 25.0 mmtm -64.1 -39.68 94.58 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.507 -179.928 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.7 tp -48.81 -34.52 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.885 -179.597 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.456 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 5.3 tp -165.35 58.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.329 0.585 . . . . 0.0 110.54 179.963 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.5 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -169.5 -10.69 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.994 179.963 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -45.36 166.78 0.04 OUTLIER Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.239 -179.961 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.45 16.91 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.815 0.341 . . . . 0.0 110.686 -179.915 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.492 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -159.94 -33.46 0.06 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.134 179.946 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.8 mt -76.37 15.99 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.239 179.824 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.483 ' H ' ' C ' ' A' ' 22' ' ' ALA . 39.2 t70 -161.06 1.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.244 -179.983 . . . . . . . . 2 2 . 1 . 057 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 52.63 26.83 4.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.593 -179.967 . . . . . . . . 1 1 . 1 . 057 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.491 179.953 . . . . . . . . 0 0 . 1 . 058 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 111.991 -0.443 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 058 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 -148.19 -10.81 0.37 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.811 0.339 . . . . 0.0 110.236 179.989 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ptm85 -61.24 -38.05 85.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.563 -179.821 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 6' ' ' LYS . 53.8 mttp -84.85 34.11 0.54 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.778 0.323 . . . . 0.0 110.267 179.661 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.5 mtt-85 53.41 -86.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.612 -179.986 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 4' ' ' LYS . 88.1 mttt -145.56 62.42 1.27 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.992 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.512 ' C ' ' H ' ' A' ' 9' ' ' ARG . 95.3 m95 -155.84 17.3 0.37 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.63 -179.81 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.679 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -75.06 33.13 0.1 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.834 179.804 . . . . . . . . 3 3 . 1 . 058 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.512 ' H ' ' C ' ' A' ' 7' ' ' TRP . 12.0 mmt85 65.48 36.77 6.48 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.518 179.748 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.7 ptt85 -51.96 -91.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.147 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -85.43 -17.23 9.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.197 179.572 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.99 -40.29 81.79 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.613 -0.804 . . . . 0.0 111.401 179.714 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -50.03 -14.4 0.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.868 0.366 . . . . 0.0 110.096 179.307 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.474 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -102.33 -37.74 3.23 Favored Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.493 -179.777 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -111.05 -42.37 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.857 0.329 . . . . 0.0 111.104 -179.486 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.3 tttt -52.89 -51.63 60.51 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.754 -179.709 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.3 pt -42.88 -40.48 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.961 -179.825 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.3 tt -173.66 86.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 109.925 179.786 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.85 -18.53 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.459 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -147.66 -170.93 16.21 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 111.775 -0.53 . . . . 0.0 111.775 179.825 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.49 -87.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.759 0.314 . . . . 0.0 110.469 -179.86 . . . . . . . . 1 1 . 1 . 058 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -64.43 -26.45 68.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.24 179.914 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -83.82 31.71 0.48 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.109 179.902 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 26' ' ' LEU . 2.9 p30 -163.64 -18.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.599 179.893 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' ASP . 54.5 t-80 58.59 -77.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.791 179.941 . . . . . . . . 2 2 . 1 . 058 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 24' ' ' ASP . 37.4 mt . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.722 0.296 . . . . 0.0 110.423 179.99 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.501 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -76.61 27.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.603 0.24 . . . . 0.0 110.758 -179.973 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.501 ' H ' ' C ' ' A' ' 1' ' ' GLY . 6.4 mmp_? -50.22 -20.7 1.1 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.238 0.542 . . . . 0.0 109.81 179.454 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' NZ ' ' CB ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -165.57 177.44 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.689 179.498 . . . . . . . . 3 3 . 1 . 059 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -83.54 131.44 34.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttt 43.12 92.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.906 178.682 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.402 ' O ' ' O ' ' A' ' 8' ' ' LEU . 68.2 t-105 -174.79 -34.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.134 179.129 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.56 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -36.94 -95.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.482 -179.748 . . . . . . . . 3 3 . 1 . 059 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.56 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 3.0 tpt180 -167.83 33.59 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.906 0.384 . . . . 0.0 110.567 -179.735 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -90.55 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.971 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.9 pt -82.8 -13.89 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.771 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -51.39 -48.85 47.15 Favored Glycine 0 C--N 1.333 0.362 0 N-CA-C 111.346 -0.701 . . . . 0.0 111.346 179.85 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -40.81 -23.55 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.027 0.441 . . . . 0.0 110.436 179.062 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -91.66 -42.63 4.75 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.425 179.917 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.4 m -107.24 -45.02 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 117.0 0.4 . . . . 0.0 111.122 -179.566 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 60.4 tttm -57.29 -28.73 63.29 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.315 -179.903 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.8 tt -65.41 1.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.973 0.416 . . . . 0.0 110.072 179.592 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.505 ' H ' ' C ' ' A' ' 16' ' ' LYS . 19.2 mt 63.58 92.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.277 -179.916 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -177.25 10.15 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 -179.986 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -159.51 -43.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 179.957 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.83 71.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.85 0.357 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 059 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.425 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -75.72 -26.06 57.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.308 179.789 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.48 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 7.9 mp -77.91 44.2 0.46 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.965 179.908 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' A' ' 22' ' ' ALA . 28.2 t70 -161.88 -39.68 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.474 -179.917 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.446 ' HD1' ' C ' ' A' ' 25' ' ' HIS . 7.5 t-80 52.34 99.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.473 179.914 . . . . . . . . 2 2 . 1 . 059 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.509 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.2 mm? . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.145 -179.932 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.229 0 N-CA-C 111.949 -0.46 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 060 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.4 mmt-85 -76.53 96.32 4.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.817 0.342 . . . . 0.0 110.477 179.968 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 50.4 ttt85 -74.04 -75.15 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.927 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -93.11 28.59 2.1 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.821 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 56.26 75.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.634 179.842 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 49.08 65.61 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 179.863 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -170.83 15.76 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.45 179.869 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.489 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.85 -70.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 0.0 109.998 -179.926 . . . . . . . . 3 3 . 1 . 060 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -169.27 21.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -42.63 -90.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.2 pp -95.55 0.66 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.54 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -72.08 -35.8 60.84 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.393 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -11.41 1.0 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.875 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -99.57 -40.46 3.17 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.367 -179.84 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.4 m -113.4 -39.73 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 116.775 0.288 . . . . 0.0 111.213 -179.445 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.9 ttpt -71.03 -23.5 62.18 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.041 -179.696 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.405 ' CG2' ' N ' ' A' ' 18' ' ' ILE . 16.2 tt -56.8 -44.65 82.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.347 -179.387 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.405 ' N ' ' CG2' ' A' ' 17' ' ' ILE . 3.4 tp -165.09 31.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 120.988 0.423 . . . . 0.0 110.936 -179.845 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -153.13 28.85 0.8 Allowed Glycine 0 C--N 1.331 0.264 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 179.926 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.402 ' O ' ' OD1' ' A' ' 24' ' ' ASP . . . -155.74 -52.13 0.01 OUTLIER Glycine 0 C--N 1.331 0.297 0 N-CA-C 111.646 -0.581 . . . . 0.0 111.646 -179.911 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.73 -60.2 3.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.8 0.333 . . . . 0.0 110.669 179.98 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.63 24.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.997 -179.767 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tp -76.81 62.49 2.05 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.691 -179.602 . . . . . . . . 1 1 . 1 . 060 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' H ' ' H ' ' A' ' 25' ' ' HIS . 54.1 m-20 -161.99 -8.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.17 179.786 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.435 ' H ' ' H ' ' A' ' 24' ' ' ASP . 29.5 t-80 -70.05 -47.65 61.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.533 179.993 . . . . . . . . 2 2 . 1 . 060 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.524 179.947 . . . . . . . . 0 0 . 1 . 061 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.487 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.202 0 N-CA-C 111.87 -0.492 . . . . 0.0 111.87 . . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -77.21 35.31 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.769 0.318 . . . . 0.0 110.617 -179.929 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.487 ' H ' ' C ' ' A' ' 1' ' ' GLY . 68.6 ttt-85 -73.57 -34.73 65.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.601 179.938 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 6' ' ' LYS . 59.1 tttm -169.81 67.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 179.974 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.519 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER 48.62 -92.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.4 179.852 . . . . . . . . 3 3 . 1 . 061 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' N ' ' O ' ' A' ' 4' ' ' LYS . 49.5 mtmt -149.25 89.25 1.64 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.114 -179.829 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.508 ' C ' ' H ' ' A' ' 9' ' ' ARG . 66.9 t-105 -163.76 -15.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.344 -179.935 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.584 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.9 pt? -61.4 1.02 0.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.431 -179.982 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.1 mmt85 63.2 38.65 10.38 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.178 179.767 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -54.98 -91.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.882 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.7 tt -88.52 -14.05 9.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 178.993 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.07 -38.42 66.12 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 179.307 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -45.66 -21.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.361 0.6 . . . . 0.0 109.931 178.825 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.441 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.9 -45.19 2.93 Favored Glycine 0 C--N 1.332 0.315 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.598 -179.859 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -103.18 -41.91 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 117.053 0.427 . . . . 0.0 111.694 -179.15 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 12' ' ' GLY . 63.2 tttm -53.06 -56.85 13.02 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.76 -179.495 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.48 2.21 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.071 0.462 . . . . 0.0 109.97 179.792 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.503 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.2 mt 61.03 92.97 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 -179.513 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.98 111.63 4.28 Favored Glycine 0 C--N 1.334 0.453 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.75 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 24' ' ' ASP . . . 50.68 68.03 1.65 Allowed Glycine 0 C--O 1.225 -0.464 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -179.406 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.474 ' C ' ' H ' ' A' ' 23' ' ' LEU . . . 56.97 22.76 7.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.256 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 66.65 0.84 1.97 Allowed 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.93 -178.996 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.474 ' H ' ' C ' ' A' ' 21' ' ' ALA . 11.0 tp -171.32 62.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.672 179.378 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.521 ' N ' ' O ' ' A' ' 20' ' ' GLY . 15.9 t70 -174.58 15.93 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.617 . . . . . . . . 2 2 . 1 . 061 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -77.04 7.39 4.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.951 -179.374 . . . . . . . . 1 1 . 1 . 061 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.0 mp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.041 179.941 . . . . . . . . 0 0 . 1 . 062 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 062 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -174.3 41.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.786 0.327 . . . . 0.0 110.5 -179.909 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -55.15 -31.12 61.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -162.27 69.62 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.652 -179.888 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 53.93 -106.66 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.668 179.974 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 65.3 mttm -148.71 61.85 1.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.324 -179.843 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.512 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 95.2 m95 -159.87 17.94 0.16 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.321 -179.904 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.421 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -75.83 -101.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.964 179.987 . . . . . . . . 3 3 . 1 . 062 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.421 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 32.0 mmt180 -133.59 13.84 4.08 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.068 179.94 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.459 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 6.3 ptm85 -58.77 -47.71 83.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.101 0.476 . . . . 0.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.459 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 1.3 mm -129.52 -20.58 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 179.033 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.25 -33.85 71.87 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.846 -0.901 . . . . 0.0 110.846 179.012 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -52.63 -14.2 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.051 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -105.72 -46.81 1.16 Allowed Glycine 0 C--N 1.336 0.582 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.442 -179.821 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.479 ' O ' ' N ' ' A' ' 19' ' ' GLY . 4.4 p -98.98 -37.59 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 116.974 0.387 . . . . 0.0 110.815 -179.428 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' GLY . 50.6 tttp -71.13 -31.62 67.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.435 179.928 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.22 -27.21 35.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.689 -179.939 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 14.8 tt -163.54 -41.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.01 -179.883 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 47.99 64.08 3.21 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.032 -179.805 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -169.11 -70.72 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 179.802 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.78 -41.52 70.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.488 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.505 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -82.68 -33.38 27.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.123 179.578 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.6 tp -77.09 33.6 0.15 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.328 179.88 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.505 ' H ' ' C ' ' A' ' 22' ' ' ALA . 26.4 t0 -171.5 -25.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.501 -179.922 . . . . . . . . 2 2 . 1 . 062 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.7 t60 52.84 82.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 -179.991 . . . . . . . . 1 1 . 1 . 062 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.3 tp . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.188 -179.904 . . . . . . . . 0 0 . 1 . 063 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 111.969 -0.452 . . . . 0.0 111.969 . . . . . . . . . 0 0 . 1 . 063 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 54.13 29.56 10.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.87 0.367 . . . . 0.0 110.541 179.96 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -63.63 -43.72 96.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.505 179.974 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -164.13 78.67 0.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.249 -179.928 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 52.01 -178.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.275 -179.807 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -84.56 87.45 7.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.38 179.943 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.406 ' H ' ' H ' ' A' ' 8' ' ' LEU . 38.9 t90 -162.1 -4.01 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.873 -179.895 . . . . . . . . 2 2 . 1 . 063 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.411 ' CD2' ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -63.94 -90.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.812 . . . . . . . . 3 3 . 1 . 063 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.401 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 12.4 tpp180 -171.75 27.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.33 -179.908 . . . . . . . . 2 2 . 1 . 063 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.16 -89.82 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.588 . . . . . . . . 2 2 . 1 . 063 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.8 mm -81.84 -20.45 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.404 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.09 -38.99 62.22 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 179.414 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.6 ttpp -45.64 -31.59 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.256 0.551 . . . . 0.0 109.81 178.685 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -86.18 -41.5 7.02 Favored Glycine 0 N--CA 1.45 -0.401 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.503 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.54 -75.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 120.424 0.154 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.5 ' C ' ' H ' ' A' ' 18' ' ' ILE . 48.9 tttp -33.94 -38.63 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.931 . . . . . . . . 2 2 . 1 . 063 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.1 tt -45.42 -13.57 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.573 -179.491 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.5 ' H ' ' C ' ' A' ' 16' ' ' LYS . 18.3 tt -161.54 -32.03 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.127 179.983 . . . . . . . . 2 2 . 1 . 063 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.51 56.79 18.18 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.014 -0.612 . . . . 0.0 111.945 -179.937 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.06 -67.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.189 -0.529 . . . . 0.0 111.951 -179.982 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.63 -48.29 49.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 0.0 110.413 179.921 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.75 -38.27 23.49 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.249 179.674 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 tp -75.68 68.37 2.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.417 -179.958 . . . . . . . . 1 1 . 1 . 063 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.482 ' OD1' ' ND1' ' A' ' 25' ' ' HIS . 29.1 p-10 -167.84 -20.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.526 179.959 . . . . . . . . 2 2 . 1 . 063 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.482 ' ND1' ' OD1' ' A' ' 24' ' ' ASP . 0.9 OUTLIER -73.18 114.45 11.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.473 179.977 . . . . . . . . 3 3 . 1 . 063 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.492 -179.998 . . . . . . . . 0 0 . 1 . 064 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 064 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -57.68 103.01 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.817 0.341 . . . . 0.0 110.519 -179.974 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 tpt85 -74.1 -36.56 64.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.816 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -145.51 53.35 1.18 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.496 -179.905 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 50.2 -96.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.615 179.968 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 46.0 mttp -145.48 70.62 1.26 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.262 -179.895 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 96.4 m95 -158.86 10.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.335 -179.919 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.474 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.44 -75.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.283 -179.714 . . . . . . . . 3 3 . 1 . 064 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -159.69 17.72 0.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.86 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.418 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 6.6 ptt180 -45.9 -88.12 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.414 179.903 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.418 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 19.7 tt -88.68 -17.77 8.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.407 179.92 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.39 -41.58 55.52 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.992 -0.623 . . . . 0.0 111.732 179.78 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -47.38 -17.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.093 0.473 . . . . 0.0 110.256 179.244 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.33 -43.14 2.6 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.387 -179.895 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.6 m -106.08 -41.7 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 116.872 0.336 . . . . 0.0 111.061 -179.531 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.5 tttm -63.9 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.707 0.289 . . . . 0.0 110.728 -179.937 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.4 tt -45.78 -22.88 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.091 -179.795 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.444 ' CG2' ' N ' ' A' ' 19' ' ' GLY . 10.3 tp -158.76 -46.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.444 ' N ' ' CG2' ' A' ' 18' ' ' ILE . . . 155.02 6.11 0.09 OUTLIER Glycine 0 C--N 1.333 0.41 0 N-CA-C 111.878 -0.489 . . . . 0.0 111.878 179.975 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.413 ' H ' ' H ' ' A' ' 19' ' ' GLY . . . 77.26 -13.1 11.01 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 121.28 -0.486 . . . . 0.0 112.022 -179.851 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.404 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -57.49 -66.52 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.813 0.34 . . . . 0.0 110.306 179.877 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.62 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.325 179.794 . . . . . . . . 1 1 . 1 . 064 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.505 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.4 mm? -77.08 -173.17 2.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.001 179.95 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 2.9 m-20 55.96 7.72 0.31 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 -179.912 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.5 ' H ' ' C ' ' A' ' 23' ' ' LEU . 55.3 t-80 -102.47 98.89 8.91 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.436 179.997 . . . . . . . . 2 2 . 1 . 064 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.502 179.942 . . . . . . . . 0 0 . 1 . 065 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.959 -0.456 . . . . 0.0 111.959 . . . . . . . . . 0 0 . 1 . 065 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -55.89 150.84 12.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.814 0.34 . . . . 0.0 110.457 179.955 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -165.12 -24.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.683 179.988 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -147.62 20.71 1.17 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.48 -179.99 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 53.87 73.95 0.35 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.505 179.766 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt 48.46 78.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.731 179.817 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 33.5 t-105 -168.72 5.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.667 -179.776 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.601 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -51.89 -74.36 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.684 . . . . . . . . 3 3 . 1 . 065 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.408 ' O ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -171.6 11.96 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.198 179.197 . . . . . . . . 3 3 . 1 . 065 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.422 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 0.5 OUTLIER -41.7 -88.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.634 . . . . . . . . 3 3 . 1 . 065 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.422 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 13.6 tt -78.34 -10.85 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.724 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.45 -44.27 95.42 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 179.507 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -46.59 -17.52 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.113 0.482 . . . . 0.0 109.879 178.654 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.78 -45.37 2.69 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.113 179.819 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.6 m -105.03 -43.04 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-N 116.938 0.369 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.0 tttt -51.84 -44.84 63.77 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.601 -179.81 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.401 ' CG2' ' H ' ' A' ' 18' ' ' ILE . 11.1 tt -50.29 -55.85 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.637 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.461 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 9.7 tt -172.67 110.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 121.148 0.499 . . . . 0.0 110.097 178.715 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 161.6 -44.47 0.38 Allowed Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.906 -179.505 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -171.89 -148.55 6.2 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.089 -179.944 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.48 12.28 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.844 0.354 . . . . 0.0 110.408 179.994 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -167.16 -48.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.349 179.907 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.9 mt -83.07 38.0 0.57 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.524 179.891 . . . . . . . . 1 1 . 1 . 065 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.415 ' H ' ' H ' ' A' ' 25' ' ' HIS . 15.1 t70 -166.59 -15.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.961 -179.917 . . . . . . . . 2 2 . 1 . 065 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' ASP . 1.0 OUTLIER -76.35 83.91 3.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.738 0.304 . . . . 0.0 110.572 -179.839 . . . . . . . . 3 3 . 1 . 065 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.8 mt . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.556 179.856 . . . . . . . . 0 0 . 1 . 066 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 066 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -56.4 -168.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.77 0.319 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -52.16 -80.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.341 179.969 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -86.73 23.64 1.64 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.455 179.921 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 54.17 -163.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.318 -179.749 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -72.7 79.53 1.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.874 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.715 ' HE1' ' HZ3' ' A' ' 16' ' ' LYS . 14.2 t-105 -160.68 -51.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.695 -179.846 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.539 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER 19.44 -102.26 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 O-C-N 123.843 0.714 . . . . 0.0 112.607 -179.775 . . . . . . . . 3 3 . 1 . 066 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.539 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 15.5 mmt-85 -141.33 20.49 2.23 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.228 -179.81 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.406 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 2.0 ptp180 -46.56 -89.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.318 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.406 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 4.3 tp -73.03 -19.17 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.725 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.02 -45.02 88.01 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.143 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -47.1 -16.45 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.0 109.909 178.681 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -95.61 -38.77 4.61 Favored Glycine 0 C--N 1.334 0.429 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.244 179.949 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.1 m -110.96 -44.6 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.914 0.357 . . . . 0.0 111.189 -179.597 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.715 ' HZ3' ' HE1' ' A' ' 7' ' ' TRP . 24.8 mmtp -56.67 -34.4 67.33 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.925 179.931 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.16 1.48 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.098 179.673 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.539 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.9 mt 62.64 96.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.295 -179.804 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.11 -53.26 0.04 OUTLIER Glycine 0 C--N 1.334 0.458 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 -179.882 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -176.03 -139.6 3.2 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.065 -179.968 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 56.03 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.674 0.273 . . . . 0.0 110.83 -179.96 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -71.77 -38.93 70.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.751 -179.982 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.8 38.27 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.472 -179.876 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.494 ' H ' ' C ' ' A' ' 22' ' ' ALA . 28.5 t70 -170.45 -37.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.605 -179.992 . . . . . . . . 2 2 . 1 . 066 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 54.51 105.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.545 179.914 . . . . . . . . 1 1 . 1 . 066 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.347 179.982 . . . . . . . . 0 0 . 1 . 067 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.265 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 067 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -58.74 -36.98 75.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt-85 52.18 -98.09 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.967 179.728 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 6' ' ' LYS . 49.9 mttp -94.05 37.05 1.1 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.008 -179.542 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 53.55 -86.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.494 179.871 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 4' ' ' LYS . 92.9 mttt -146.94 78.63 1.5 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.967 0.413 . . . . 0.0 110.119 179.926 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.455 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 92.7 m95 -158.47 -0.6 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.214 179.98 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.17 -8.03 56.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.018 179.792 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 63.97 38.61 8.59 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.042 179.89 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.294 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mm -101.91 -13.58 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.293 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.08 -34.22 72.19 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 110.766 -0.933 . . . . 0.0 110.766 179.313 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -51.34 -19.07 1.16 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 109.547 178.807 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.25 -46.02 2.68 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.367 -179.672 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.48 -41.49 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 116.874 0.337 . . . . 0.0 111.434 -179.447 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.4 tttm -60.91 -33.55 73.31 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.581 -179.786 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.3 tt -62.18 -2.19 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.013 0.435 . . . . 0.0 110.119 179.522 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.2 mt 63.92 77.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.18 -179.565 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -172.52 34.32 0.13 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.21 -179.931 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.486 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -175.71 -175.63 43.28 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.08 179.886 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.55 12.21 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.058 0.456 . . . . 0.0 110.148 -179.726 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.486 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -172.7 -49.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 067 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.7 tp -83.82 59.84 5.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.17 179.578 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -162.92 -22.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 -179.852 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -72.19 -60.8 2.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.507 -179.993 . . . . . . . . 1 1 . 1 . 067 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.506 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.069 -179.965 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 068 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 37.9 ptt180 -166.77 -4.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.691 0.282 . . . . 0.0 110.605 179.935 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -50.87 -31.29 16.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.888 0.375 . . . . 0.0 110.288 179.799 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -146.41 159.68 43.07 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.7 179.694 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' N ' ' A' ' 7' ' ' TRP . 15.6 ptm180 -52.7 173.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.372 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 1.0 OUTLIER -56.42 83.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.832 0.349 . . . . 0.0 110.165 -179.741 . . . . . . . . 3 3 . 1 . 068 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' N ' ' O ' ' A' ' 5' ' ' ARG . 73.9 t90 -171.62 -10.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.745 179.965 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.53 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -40.56 -89.9 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.121 -179.925 . . . . . . . . 3 3 . 1 . 068 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.53 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 32.9 mmm-85 -140.55 13.49 2.34 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.918 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.407 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 5.4 ptm180 -40.97 -88.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.538 179.769 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.407 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.3 tp -83.04 -15.46 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.444 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.17 -48.29 84.09 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.49 -179.937 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -46.26 -16.12 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.143 -0.621 . . . . 0.0 110.404 179.391 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.502 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -95.96 -40.13 4.14 Favored Glycine 0 C--N 1.336 0.561 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.863 -179.964 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.7 m -112.06 -43.65 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 120.803 0.335 . . . . 0.0 110.249 179.852 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.561 ' N ' ' O ' ' A' ' 12' ' ' GLY . 13.4 ttmm -65.51 -37.44 86.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.736 179.733 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 8.1 tt -42.1 -20.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.069 179.946 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.49 ' N ' ' O ' ' A' ' 16' ' ' LYS . 29.9 mt -129.42 -80.25 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.343 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 165.1 6.77 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 121.184 -0.532 . . . . 0.0 111.951 179.965 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 63.12 5.47 10.31 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.899 -179.959 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.58 8.46 2.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.332 . . . . 0.0 110.558 -179.99 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.6 -53.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.549 -179.94 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.0 tp -78.54 55.83 1.69 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.361 179.901 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.489 ' C ' ' H ' ' A' ' 26' ' ' LEU . 43.7 t0 -164.83 6.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.343 179.997 . . . . . . . . 2 2 . 1 . 068 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -52.36 -11.29 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.489 -179.999 . . . . . . . . 1 1 . 1 . 068 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.489 ' H ' ' C ' ' A' ' 24' ' ' ASP . 9.6 mp . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 069 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -170.3 39.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.799 0.333 . . . . 0.0 110.549 -179.997 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -73.53 -19.46 60.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 -179.971 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -147.83 64.47 1.12 Allowed 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.749 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 48.94 -158.2 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.596 -179.682 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 54.6 mttm -100.75 64.05 1.08 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.756 -179.904 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 4.7 m-90 -160.48 11.67 0.11 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.477 179.85 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.483 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.16 -64.12 0.86 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.965 0.412 . . . . 0.0 110.207 179.853 . . . . . . . . 3 3 . 1 . 069 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.6 tpp85 -170.56 19.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.864 179.827 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -42.54 -89.5 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.709 179.825 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.3 tp -81.46 -22.75 10.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.375 -179.743 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.28 -42.55 73.92 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.283 179.574 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -45.29 -21.06 0.07 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.085 0.469 . . . . 0.0 110.216 179.073 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.1 -41.08 4.4 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.641 -179.623 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.7 m -111.68 -42.22 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.98 0.39 . . . . 0.0 111.495 -179.302 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.3 tttm -57.83 -35.51 70.99 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.588 -179.6 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.3 tt -62.5 -3.49 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 110.174 179.754 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' H ' ' C ' ' A' ' 16' ' ' LYS . 9.0 mt 63.41 76.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.248 -179.696 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -72.18 -13.62 76.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.026 -179.913 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.66 -36.62 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.045 -179.924 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.493 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -51.57 -73.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.786 0.327 . . . . 0.0 110.497 179.93 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -30.02 65.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.486 -179.991 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -78.69 48.07 0.78 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.004 -179.987 . . . . . . . . 2 2 . 1 . 069 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -167.04 -27.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.552 179.969 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.9 t60 50.61 72.62 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.607 -179.95 . . . . . . . . 1 1 . 1 . 069 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.8 tt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.175 -179.888 . . . . . . . . 0 0 . 1 . 070 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.499 ' O ' ' N ' ' A' ' 4' ' ' LYS . 41.8 mtm-85 55.84 -80.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.642 0.258 . . . . 0.0 110.826 179.964 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' A' ' 1' ' ' GLY . 50.7 ttp180 56.91 -80.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.669 179.962 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 2' ' ' ARG . 0.1 OUTLIER -111.24 53.13 0.72 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.801 0.334 . . . . 0.0 110.129 179.886 . . . . . . . . 3 3 . 1 . 070 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.485 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 10.8 mpt_? 51.61 75.05 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.146 -179.875 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.3 mttm 54.47 -165.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.426 -179.857 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.516 ' C ' ' H ' ' A' ' 9' ' ' ARG . 4.0 m0 60.92 10.02 2.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.718 179.998 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 2' ' ' ARG . 3.3 pp -73.69 20.76 0.09 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.801 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' A' ' 7' ' ' TRP . 35.8 mmm-85 60.84 43.35 12.07 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.922 179.652 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -57.71 -81.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.027 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.2 tp -97.25 -16.26 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.312 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.517 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.66 -35.3 62.04 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.187 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -50.2 -16.87 0.36 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.119 0.485 . . . . 0.0 110.345 179.292 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -103.1 -40.14 2.51 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.406 -179.628 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.483 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.3 m -108.49 -40.92 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 116.698 0.249 . . . . 0.0 111.233 -179.429 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 12' ' ' GLY . 33.0 ttmt -69.16 -30.98 69.31 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.6 tt -45.19 -22.3 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.052 -179.87 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 17.1 tt -163.42 -40.57 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.793 179.801 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 68.45 65.05 2.8 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.031 -0.604 . . . . 0.0 111.784 -179.793 . . . . . . . . 2 2 . 1 . 070 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -175.74 -61.62 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.258 -0.496 . . . . 0.0 111.952 -179.993 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.21 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.347 179.837 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.15 -30.98 67.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.071 179.601 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.33 61.68 3.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.178 179.839 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -168.12 -11.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.205 -179.977 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -79.85 -54.09 6.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.55 179.982 . . . . . . . . 1 1 . 1 . 070 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.471 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.148 -179.93 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 071 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.429 ' N ' ' CD ' ' A' ' 2' ' ' ARG . 0.5 OUTLIER -56.38 92.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.999 . . . . . . . . 3 3 . 1 . 071 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -60.74 -38.57 85.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.537 -179.871 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -162.62 53.79 0.2 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 -179.844 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.508 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 9.9 mpt_? 45.81 -170.11 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.576 179.873 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 63.2 mmtt -76.42 64.84 2.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.296 179.696 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CZ3' ' NH2' ' A' ' 10' ' ' ARG . 98.9 m95 -157.2 9.18 0.19 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.37 -179.821 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.475 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.78 -68.87 0.14 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.894 179.935 . . . . . . . . 3 3 . 1 . 071 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -168.89 21.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.17 179.537 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.504 ' NH2' ' CZ3' ' A' ' 7' ' ' TRP . 8.1 ptt180 -44.3 -90.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.188 179.507 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.415 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.5 tp -74.25 -20.91 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.473 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.97 -44.39 94.54 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.597 179.872 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.15 -13.26 0.3 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 109.795 179.299 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -99.65 -28.79 7.29 Favored Glycine 0 C--N 1.335 0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.372 -179.977 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 23.0 m -127.5 -42.59 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.885 0.343 . . . . 0.0 111.166 -179.503 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 12' ' ' GLY . 15.1 tmtt? -53.71 -53.3 54.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 110.47 -179.912 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.9 tp -72.23 9.47 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.191 0.52 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.481 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 58.1 81.36 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.446 -179.965 . . . . . . . . 2 2 . 1 . 071 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.74 122.01 8.16 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.843 179.971 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -48.96 -50.32 27.4 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.183 -0.532 . . . . 0.0 111.991 -179.959 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.16 -42.24 50.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 110.646 -179.892 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.05 -35.83 64.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.476 179.947 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.8 tp -79.29 51.48 1.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.432 -179.997 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -167.38 -54.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.583 -179.97 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -79.63 88.96 5.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.564 179.946 . . . . . . . . 1 1 . 1 . 071 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.7 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.129 179.968 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 111.954 -0.459 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 072 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 4' ' ' LYS . 73.1 mtt85 -58.63 -69.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.562 -179.908 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 49.73 -91.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.344 -179.908 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.455 ' N ' ' O ' ' A' ' 2' ' ' ARG . 68.1 mmtt -103.07 138.19 40.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.632 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -71.02 74.82 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.858 0.361 . . . . 0.0 110.702 -179.834 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.494 ' O ' ' NE ' ' A' ' 10' ' ' ARG . 91.1 mttt 56.27 35.56 25.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.042 179.624 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.421 ' C ' ' H ' ' A' ' 9' ' ' ARG . 69.3 m95 -124.53 8.0 8.31 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 178.91 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.35 42.94 0.29 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.236 179.512 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.649 ' NH2' ' HZ1' ' A' ' 16' ' ' LYS . 4.8 mmp_? 60.68 37.99 18.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.874 179.55 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.494 ' NE ' ' O ' ' A' ' 6' ' ' LYS . 7.2 ptt85 -49.18 -82.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.18 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.5 tt -95.31 -14.02 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.364 179.319 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.69 -40.49 88.59 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.412 -0.899 . . . . 0.0 111.34 179.801 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -49.93 -16.47 0.28 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 109.616 178.85 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.47 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -94.86 -45.03 3.22 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.282 179.93 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -109.38 -42.68 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.959 0.38 . . . . 0.0 111.47 -179.497 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.649 ' HZ1' ' NH2' ' A' ' 9' ' ' ARG . 84.5 tttt -49.28 -48.7 45.82 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.622 -179.573 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.8 tt -59.11 -32.17 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.037 179.707 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.445 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 9.3 tt -171.38 113.15 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.172 0.511 . . . . 0.0 110.653 179.077 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -80.05 56.5 4.59 Favored Glycine 0 C--N 1.33 0.249 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -179.997 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -44.21 -19.68 0.14 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.415 -179.768 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.423 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -77.08 18.97 0.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.862 0.363 . . . . 0.0 110.608 179.983 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.492 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.29 -39.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.322 179.937 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.516 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -78.89 56.52 1.95 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.808 179.846 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -163.29 -39.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.494 -179.761 . . . . . . . . 1 1 . 1 . 072 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.83 71.17 1.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.674 -179.969 . . . . . . . . 2 2 . 1 . 072 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.495 179.956 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 . . . . . . . . . 0 0 . 1 . 073 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -161.77 54.01 0.25 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.805 0.336 . . . . 0.0 110.608 179.974 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -61.43 -26.99 68.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.765 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -164.27 63.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.638 179.99 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 25.3 ttt85 59.88 -125.7 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.102 179.899 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.643 ' HZ2' ' NH2' ' A' ' 10' ' ' ARG . 62.2 mttm -122.3 86.29 2.56 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.82 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.487 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 93.1 m95 -158.74 -3.89 0.08 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.563 -179.765 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.472 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -67.63 -89.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 179.801 . . . . . . . . 3 3 . 1 . 073 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -173.89 18.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.324 -179.98 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.643 ' NH2' ' HZ2' ' A' ' 6' ' ' LYS . 2.0 ptp180 -46.92 -88.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.735 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.0 tt -85.57 -12.63 11.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.792 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.66 -41.51 74.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.65 179.775 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -47.76 -16.7 0.08 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.018 0.437 . . . . 0.0 110.139 179.121 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.07 -44.26 2.26 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.399 179.943 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.2 m -103.57 -41.53 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.976 0.388 . . . . 0.0 110.9 -179.647 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 83.1 tttt -59.32 -35.46 73.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.689 0.28 . . . . 0.0 110.528 179.912 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.6 tt -68.49 4.56 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.069 0.462 . . . . 0.0 110.017 179.799 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.502 ' H ' ' C ' ' A' ' 16' ' ' LYS . 18.3 mt 61.89 61.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.383 -179.914 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.48 74.36 2.1 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.979 179.96 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.457 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 72.57 89.73 0.13 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.101 179.806 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.67 12.34 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.457 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . 57.57 43.45 22.57 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.71 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.46 20.44 8.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -178.342 . . . . . . . . 2 2 . 1 . 073 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.1 t0 45.99 40.95 7.56 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.915 -179.237 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -68.22 -66.73 0.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.633 -179.963 . . . . . . . . 1 1 . 1 . 073 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.793 -179.806 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 111.935 -0.466 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 074 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.504 ' N ' ' CD ' ' A' ' 2' ' ' ARG . 9.3 mpt_? -78.94 58.79 2.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.762 0.315 . . . . 0.0 110.331 -179.999 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.419 ' C ' ' H ' ' A' ' 5' ' ' ARG . 17.2 mmm180 -68.93 -52.85 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.54 179.966 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 6' ' ' LYS . 12.5 mptt -79.95 19.55 0.69 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.316 -179.862 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 3' ' ' ARG . 65.8 mtt-85 53.21 -86.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.661 179.997 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.3 mttm -142.84 53.44 1.39 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.167 179.984 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -151.08 8.62 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.652 179.824 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.47 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 1.8 pt? -48.49 -36.63 15.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.233 -179.723 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.535 HH22 ' CA ' ' A' ' 17' ' ' ILE . 6.7 mmt180 159.22 24.66 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.83 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -42.26 -91.33 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 179.772 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -92.27 -19.37 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.138 -179.9 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.11 -38.03 60.11 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.03 -0.605 . . . . 0.0 111.738 179.647 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -50.15 -16.59 0.32 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.041 0.448 . . . . 0.0 110.251 179.63 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -101.39 -39.69 2.96 Favored Glycine 0 C--N 1.333 0.399 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.422 -179.808 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.3 m -109.19 -43.19 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 116.78 0.29 . . . . 0.0 111.189 -179.5 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 87.1 tttt -58.41 -39.61 80.18 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.499 -179.854 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.535 ' CA ' HH22 ' A' ' 9' ' ' ARG . 15.4 tt -49.97 -28.02 4.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.504 179.911 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' O ' ' CG2' ' A' ' 18' ' ' ILE . 16.9 tt -170.15 63.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.4 0.619 . . . . 0.0 110.346 179.868 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -174.79 -31.31 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.967 -179.968 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.491 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -72.75 70.97 1.13 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 121.129 -0.557 . . . . 0.0 111.958 179.963 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 54.03 9.98 0.25 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.182 -179.926 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.491 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . 57.88 45.69 17.98 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -178.691 . . . . . . . . 2 2 . 1 . 074 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.1 mt 57.89 17.11 4.05 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -178.214 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 t70 49.5 48.45 21.31 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.685 -179.099 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -76.42 -59.14 2.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.807 -179.663 . . . . . . . . 1 1 . 1 . 074 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.482 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.1 mp . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.081 -179.931 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.506 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 . . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -76.24 19.81 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.684 0.278 . . . . 0.0 110.516 179.998 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.506 ' H ' ' C ' ' A' ' 1' ' ' GLY . 78.1 ttt180 -56.29 -44.97 80.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.5 -179.977 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -157.57 69.1 0.54 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 0.0 110.666 -179.851 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.481 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 8.9 mpt_? 54.03 -103.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.297 179.864 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 85.2 mttt -146.31 81.41 1.58 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 -179.871 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 96.5 m95 -159.35 7.29 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.334 179.919 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.464 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.95 -68.96 0.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.126 -179.925 . . . . . . . . 3 3 . 1 . 075 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.8 tpp85 -165.65 18.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.256 179.918 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -45.36 -88.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.046 179.413 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.3 tt -80.48 -17.96 12.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.363 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.13 -45.79 62.87 Favored Glycine 0 N--CA 1.451 -0.309 0 N-CA-C 111.609 -0.597 . . . . 0.0 111.609 179.568 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.62 -15.66 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.159 0.504 . . . . 0.0 110.047 179.044 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.484 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.17 -40.61 3.0 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.474 -179.979 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -107.7 -41.34 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 117.129 0.464 . . . . 0.0 111.051 -179.517 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' C ' ' H ' ' A' ' 18' ' ' ILE . 20.6 tptp -51.24 -59.35 4.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.767 0.318 . . . . 0.0 110.321 179.85 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.4 tt -65.29 0.77 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 110.094 179.769 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.507 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.2 mt 63.87 107.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.415 -179.947 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.49 -87.75 0.07 OUTLIER Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.67 179.992 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.21 -33.33 45.43 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.778 179.844 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.55 -51.95 51.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.837 0.351 . . . . 0.0 110.429 179.867 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.46 -43.13 64.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.325 179.8 . . . . . . . . 1 1 . 1 . 075 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.486 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 7.5 mp -81.73 63.16 5.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.084 179.894 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' H ' ' H ' ' A' ' 25' ' ' HIS . 33.2 t70 -170.32 -16.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.29 179.897 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.414 ' H ' ' H ' ' A' ' 24' ' ' ASP . 19.0 t60 -92.3 98.59 11.59 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.586 179.951 . . . . . . . . 2 2 . 1 . 075 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.4 mm? . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.048 179.936 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 076 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.481 ' O ' ' N ' ' A' ' 4' ' ' LYS . 89.0 mtt180 -63.36 -68.41 0.34 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.35 . . . . 0.0 110.508 -179.99 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 58.12 -78.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.956 179.897 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.481 ' N ' ' O ' ' A' ' 2' ' ' ARG . 74.0 mttt -85.62 24.41 1.22 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.74 0.305 . . . . 0.0 110.613 -179.797 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.4 mtm180 50.47 -121.15 1.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.194 -179.775 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -99.64 68.06 1.53 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.6 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -163.03 4.28 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.779 -179.709 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.473 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.52 -70.85 0.09 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.399 -179.93 . . . . . . . . 3 3 . 1 . 076 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.57 18.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.15 -179.9 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -41.92 -89.7 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.329 179.815 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.6 pt -80.25 -17.26 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 179.241 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.84 -41.64 94.2 Favored Glycine 0 CA--C 1.507 -0.44 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.61 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -48.8 -15.88 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.254 0.549 . . . . 0.0 109.683 178.46 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.473 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.25 -45.45 2.01 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.607 -179.895 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.9 p -102.18 -40.38 7.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 117.205 0.503 . . . . 0.0 110.971 -179.389 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 55.6 tttm -53.51 -62.68 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.823 0.344 . . . . 0.0 110.443 -179.983 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 tt -75.39 10.51 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.122 -179.93 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.445 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.7 mt 60.04 99.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.23 -179.851 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -74.08 115.59 4.97 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 121.291 -0.48 . . . . 0.0 112.177 -179.725 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.494 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -76.9 -8.56 86.7 Favored Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 179.793 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.44 13.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.878 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.48 -54.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.243 179.967 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.6 mt -79.62 57.95 2.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.47 179.869 . . . . . . . . 1 1 . 1 . 076 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.415 ' H ' ' H ' ' A' ' 25' ' ' HIS . 38.6 t0 -166.75 -2.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.703 -179.879 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' ASP . 76.7 t60 -71.39 -42.89 67.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.529 179.995 . . . . . . . . 2 2 . 1 . 076 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.0 mt . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.661 -179.965 . . . . . . . . 0 0 . 1 . 077 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 077 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -76.68 63.45 2.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.758 0.313 . . . . 0.0 110.656 179.987 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 65.5 mtp85 -80.37 -48.82 12.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.592 -179.977 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.4 mtpt -99.15 18.71 16.79 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.8 -179.916 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 54.15 84.13 0.07 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.844 179.711 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 2.9 mptp? 46.2 67.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.776 179.651 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -171.32 7.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.37 179.864 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.573 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.2 -70.82 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.635 -179.701 . . . . . . . . 3 3 . 1 . 077 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.35 16.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.927 -179.996 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -40.03 -89.59 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.382 179.914 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.8 tt -83.31 -16.6 11.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.238 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.96 -41.74 85.22 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.501 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -48.83 -15.2 0.08 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.037 0.446 . . . . 0.0 110.165 179.023 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.86 -40.69 2.1 Favored Glycine 0 C--N 1.337 0.632 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.724 -179.702 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -106.78 -37.92 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-N 117.055 0.428 . . . . 0.0 111.091 -179.469 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.5 tttt -62.56 -45.95 90.58 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.909 -179.772 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 tp -51.78 -31.37 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.297 -179.713 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.497 ' CG1' ' H ' ' A' ' 19' ' ' GLY . 3.2 pt -117.03 -108.77 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.086 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.5 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -166.16 11.97 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 121.271 -0.49 . . . . 0.0 111.901 179.916 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.49 -13.57 2.84 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.017 -179.924 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.5 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -74.7 -54.38 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 -179.925 . . . . . . . . 2 2 . 1 . 077 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.98 -12.18 3.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.631 -179.988 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.3 tp -67.46 -27.49 67.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 -179.93 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -155.02 57.22 0.66 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.512 -179.964 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -54.84 137.56 44.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.543 -179.992 . . . . . . . . 1 1 . 1 . 077 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.431 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 179.981 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.406 ' O ' ' O ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.012 -0.435 . . . . 0.0 112.012 . . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.406 ' O ' ' O ' ' A' ' 1' ' ' GLY . 51.3 mtm180 59.79 146.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 0.0 110.728 -179.981 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 57.9 ttt-85 -167.37 -53.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.592 179.955 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.574 ' C ' ' H ' ' A' ' 6' ' ' LYS . 19.3 ptmt -166.04 33.1 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.543 179.993 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.422 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 11.4 mpt_? 59.1 -6.12 0.06 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.788 179.901 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.574 ' H ' ' C ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -144.43 164.01 32.1 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.9 0.381 . . . . 0.0 110.192 179.792 . . . . . . . . 3 3 . 1 . 078 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.4 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 72.5 t-105 56.36 6.67 0.28 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.069 179.62 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.579 ' CD1' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -69.49 -84.45 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.653 . . . . . . . . 3 3 . 1 . 078 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.579 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 18.6 mmt85 -136.0 16.5 3.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.965 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.434 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 0.9 OUTLIER -44.34 -88.5 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.705 . . . . . . . . 3 3 . 1 . 078 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.434 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 5.7 tp -81.9 -15.66 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.889 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.9 -38.55 85.08 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 179.387 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -51.75 -12.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.074 0.464 . . . . 0.0 110.073 179.212 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.48 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.91 -39.38 2.33 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.565 -179.778 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -108.07 -41.07 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 116.935 0.367 . . . . 0.0 110.892 -179.409 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.493 ' C ' ' H ' ' A' ' 18' ' ' ILE . 18.8 tptm -56.22 -54.1 49.26 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.164 -179.99 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 tt -76.02 14.64 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 109.836 179.767 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.493 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 60.58 111.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.426 -179.946 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.28 -105.68 0.19 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.189 -0.529 . . . . 0.0 111.819 -179.946 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.464 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -68.33 -153.02 0.45 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.064 -0.589 . . . . 0.0 111.785 179.931 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.08 15.09 0.16 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.946 0.403 . . . . 0.0 110.217 -179.703 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -164.38 -57.57 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.854 179.992 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.9 mt -80.77 23.47 0.53 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.115 179.533 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.448 ' H ' ' C ' ' A' ' 22' ' ' ALA . 34.1 t70 -168.02 14.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.669 -179.832 . . . . . . . . 2 2 . 1 . 078 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -61.87 -59.35 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.533 -179.944 . . . . . . . . 1 1 . 1 . 078 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.504 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.914 -179.843 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.009 -0.436 . . . . 0.0 112.009 . . . . . . . . . 0 0 . 1 . 079 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.7 ttt85 -170.1 -53.83 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.845 0.355 . . . . 0.0 110.45 -179.939 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -75.92 -29.53 58.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.546 -179.981 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -155.28 61.33 0.63 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.487 -179.751 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 43.89 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.082 179.912 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -84.16 69.23 10.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.198 179.895 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.514 ' C ' ' H ' ' A' ' 9' ' ' ARG . 71.5 t-105 -146.19 -9.39 0.51 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.13 -179.803 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.438 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.0 OUTLIER -70.94 14.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.431 -179.855 . . . . . . . . 3 3 . 1 . 079 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.514 ' H ' ' C ' ' A' ' 7' ' ' TRP . 44.1 mmt-85 64.62 43.03 4.49 Favored 'General case' 0 CA--C 1.521 -0.155 0 O-C-N 123.065 0.228 . . . . 0.0 111.271 179.508 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -53.77 -93.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.643 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.4 tp -78.36 -16.5 13.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.687 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -59.21 -40.0 95.24 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 120.525 -0.845 . . . . 0.0 110.99 179.274 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -52.36 -14.35 0.46 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.269 0.557 . . . . 0.0 109.866 179.119 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -101.89 -29.6 6.1 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.55 -179.686 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.3 m -124.61 -42.29 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.765 0.283 . . . . 0.0 111.168 -179.355 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.5 tttp -59.8 -50.79 72.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.844 -179.615 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.8 tp -75.28 16.73 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.178 0.513 . . . . 0.0 110.335 -179.886 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.507 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.7 mm 58.04 87.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.357 179.923 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.53 70.36 1.94 Allowed Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.817 -0.513 . . . . 0.0 111.817 179.918 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.7 -35.46 2.11 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.252 -179.863 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.29 -49.8 60.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.758 0.314 . . . . 0.0 110.612 -180.0 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.524 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -79.91 -43.17 22.67 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.954 -179.656 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.8 mt -74.73 25.53 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.136 -179.626 . . . . . . . . 1 1 . 1 . 079 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' H ' ' C ' ' A' ' 22' ' ' ALA . 46.9 t0 -171.32 -6.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 0.0 110.295 179.561 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.433 ' H ' ' H ' ' A' ' 24' ' ' ASP . 15.2 m80 54.71 75.68 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.489 -179.908 . . . . . . . . 2 2 . 1 . 079 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.3 tp . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.314 -179.974 . . . . . . . . 0 0 . 1 . 080 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 111.93 -0.468 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 080 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -71.94 72.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.22 179.869 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.3 ttm-85 -67.45 -41.35 84.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.4 ptmm? -161.02 49.82 0.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.475 -179.783 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 mtt85 55.71 -163.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.324 179.997 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 84.5 mttt -74.21 79.44 1.79 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.056 -179.402 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.482 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 91.6 m95 -160.34 1.67 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.152 179.656 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.484 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -51.21 -86.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.652 . . . . . . . . 3 3 . 1 . 080 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.484 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 5.7 tpp85 -160.82 23.92 0.14 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.266 179.931 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.4 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 11.5 ptt85 -49.08 -89.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.842 179.442 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.4 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 2.2 mm -78.29 -19.9 13.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.32 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.92 -38.53 89.21 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.397 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -51.28 -17.18 0.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.658 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.04 -47.01 2.13 Favored Glycine 0 C--N 1.334 0.448 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.119 179.942 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -101.67 -42.81 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-N 116.918 0.359 . . . . 0.0 111.137 -179.701 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.538 ' C ' ' H ' ' A' ' 18' ' ' ILE . 19.7 tptm -61.83 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.17 179.945 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.2 tt -62.5 -0.87 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.913 0.387 . . . . 0.0 110.047 179.52 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.538 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.8 mt 64.54 75.18 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.305 -179.874 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.98 32.82 0.23 Allowed Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.642 -179.985 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.51 -41.16 0.02 OUTLIER Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 179.991 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.96 -66.38 0.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 110.282 179.742 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.72 -34.68 39.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.331 179.76 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.91 76.18 5.4 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.307 0.575 . . . . 0.0 109.738 179.98 . . . . . . . . 2 2 . 1 . 080 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -172.28 -31.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.009 -179.829 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -79.45 63.63 4.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.644 179.946 . . . . . . . . 1 1 . 1 . 080 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.3 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.458 179.96 . . . . . . . . 0 0 . 1 . 081 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.457 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.05 -0.42 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.537 ' C ' ' H ' ' A' ' 4' ' ' LYS . 47.1 ttp180 -50.49 -14.21 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.838 0.352 . . . . 0.0 110.517 179.974 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.457 ' H ' ' C ' ' A' ' 1' ' ' GLY . 89.9 mtm180 -75.85 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.359 179.501 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.537 ' H ' ' C ' ' A' ' 2' ' ' ARG . 3.7 tmtm? -169.39 -50.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.847 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -56.03 83.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.383 179.237 . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' LYS . 64.2 mmtt 59.39 69.24 0.73 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 -179.919 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.506 ' C ' ' H ' ' A' ' 9' ' ' ARG . 78.9 t90 -160.26 -16.76 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.649 179.532 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.587 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 2.0 pt? -70.46 9.95 0.54 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.506 ' H ' ' C ' ' A' ' 7' ' ' TRP . 10.3 mmm180 54.08 53.13 11.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 110.301 179.97 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.591 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 13.4 ptt85 -68.57 -60.15 2.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.64 -179.871 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.591 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 17.3 tt -112.07 -19.09 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.707 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.571 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.11 -46.23 70.78 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.841 179.649 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -50.27 -13.62 0.13 Allowed 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.94 -0.741 . . . . 0.0 109.924 179.236 . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -95.76 -44.28 3.17 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.488 179.847 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.486 ' O ' ' N ' ' A' ' 19' ' ' GLY . 15.7 m -108.35 -43.37 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.831 0.348 . . . . 0.0 110.347 179.706 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.571 ' N ' ' O ' ' A' ' 12' ' ' GLY . 33.4 ttmt -64.88 -41.26 95.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 179.931 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.5 tp -38.69 -36.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.62 -179.617 . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 12.0 tt -163.46 39.77 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 121.422 0.63 . . . . 0.0 110.687 -179.587 . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -150.6 7.28 0.69 Allowed Glycine 0 C--N 1.331 0.281 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.479 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.476 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -152.2 -27.0 0.04 OUTLIER Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 179.783 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.22 16.23 0.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.93 0.395 . . . . 0.0 110.181 179.643 . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.476 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -158.92 -38.57 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.984 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.408 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 10.1 mp -78.87 56.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.849 179.736 . . . . . . . . 2 2 . 1 . 081 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -166.23 -48.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.527 -179.937 . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 53.9 61.37 3.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 -179.942 . . . . . . . . 1 1 . 1 . 081 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.3 mm? . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.139 179.986 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.221 0 N-CA-C 111.953 -0.459 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 082 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -171.01 27.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.352 . . . . 0.0 110.442 -179.973 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -62.24 -14.43 38.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.594 -179.889 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -159.79 77.52 0.67 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.73 -179.966 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 47.74 -106.87 0.17 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 179.633 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -149.18 81.59 1.42 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.829 0.347 . . . . 0.0 110.246 -179.876 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.631 ' HE1' ' HZ3' ' A' ' 16' ' ' LYS . 73.8 t-105 -171.17 7.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.164 -179.934 . . . . . . . . 2 2 . 1 . 082 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.482 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.65 -69.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.106 -179.883 . . . . . . . . 3 3 . 1 . 082 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -160.36 20.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.006 -179.959 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -44.81 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.915 179.493 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.1 pt -80.51 -19.17 11.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.143 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.43 -39.37 73.15 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 179.328 . . . . . . . . 2 2 . 1 . 082 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -46.52 -19.35 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.192 0.52 . . . . 0.0 109.909 178.642 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.04 -46.27 2.67 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.215 -179.919 . . . . . . . . 2 2 . 1 . 082 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 m -100.47 -44.57 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 117.033 0.417 . . . . 0.0 111.466 -179.501 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.631 ' HZ3' ' HE1' ' A' ' 7' ' ' TRP . 23.6 mmtp -59.7 -32.66 70.72 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.111 -179.868 . . . . . . . . 2 2 . 1 . 082 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.14 -1.83 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.077 0.465 . . . . 0.0 109.863 179.496 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.5 ' H ' ' C ' ' A' ' 16' ' ' LYS . 10.6 mt 64.01 85.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.291 -179.613 . . . . . . . . 2 2 . 1 . 082 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.02 -124.01 2.44 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 179.988 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.422 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -56.34 -162.84 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.077 -0.583 . . . . 0.0 111.931 -179.964 . . . . . . . . 2 2 . 1 . 082 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.33 14.14 0.35 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.953 0.406 . . . . 0.0 110.339 -179.89 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.422 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -168.49 -51.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.079 179.983 . . . . . . . . 2 2 . 1 . 082 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.4 tp -80.69 63.01 4.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.222 179.787 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -160.91 -25.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.518 -179.822 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -77.59 -53.99 6.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.666 179.929 . . . . . . . . 1 1 . 1 . 082 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 7.6 mp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.118 -179.915 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 N-CA-C 111.969 -0.453 . . . . 0.0 111.969 . . . . . . . . . 0 0 . 1 . 083 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -167.01 105.95 0.58 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.829 0.347 . . . . 0.0 110.535 -179.98 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -135.2 -17.34 1.83 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 179.978 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -163.88 59.2 0.16 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.086 179.769 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' TRP . 46.6 ttt85 59.64 151.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.249 -179.711 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -53.44 84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.55 -179.934 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.513 ' N ' ' O ' ' A' ' 5' ' ' ARG . 75.7 t-105 -171.87 10.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.408 -179.812 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.479 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.29 -68.42 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.169 -179.903 . . . . . . . . 3 3 . 1 . 083 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -166.15 18.76 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.157 179.937 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -43.84 -89.08 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.344 179.748 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.4 tp -80.5 -19.75 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.635 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.5 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.81 -41.92 84.56 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.606 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -49.89 -18.11 0.47 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.493 0.664 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.426 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -93.32 -40.83 4.69 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.853 -179.805 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.6 p -113.12 -40.78 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 117.272 0.536 . . . . 0.0 111.247 -179.184 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.4 tptt -51.14 -57.26 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.374 179.967 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.4 tt -71.5 -2.14 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.211 0.529 . . . . 0.0 109.624 179.442 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.9 mt 61.86 80.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.462 179.853 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -79.95 80.86 1.56 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.02 179.959 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.492 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -53.79 -11.29 1.97 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.814 179.915 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -75.55 16.41 0.37 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.73 0.3 . . . . 0.0 110.55 179.894 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.492 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -161.47 -42.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.4 -179.955 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.476 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 8.2 mp -79.87 58.97 3.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 083 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -162.08 -55.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.961 179.992 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -95.94 77.49 3.17 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.542 179.854 . . . . . . . . 1 1 . 1 . 083 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.483 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.3 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.179 179.956 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.5 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 . . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 65.79 -3.07 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.885 0.374 . . . . 0.0 110.391 179.984 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.5 ' H ' ' C ' ' A' ' 1' ' ' GLY . 38.3 ttm180 -69.2 -19.34 63.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.381 179.811 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -135.47 37.74 2.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.441 -179.925 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 54.27 -163.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.681 179.77 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 0.9 OUTLIER -64.14 98.34 0.22 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.186 179.974 . . . . . . . . 3 3 . 1 . 084 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.415 ' O ' ' C ' ' A' ' 8' ' ' LEU . 77.0 t-105 -166.29 -83.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.248 179.727 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.511 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER 24.43 -103.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 112.465 179.394 . . . . . . . . 3 3 . 1 . 084 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.511 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 6.3 tpp85 -168.96 31.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.006 -179.769 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -53.16 -89.61 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.359 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.0 tt -84.09 -14.79 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.187 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.51 -46.46 58.49 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.493 179.656 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -43.88 -18.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.999 0.428 . . . . 0.0 110.337 178.903 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -96.79 -43.36 3.12 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.391 -179.982 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.7 m -105.41 -42.8 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 117.034 0.417 . . . . 0.0 110.889 -179.653 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.514 ' C ' ' H ' ' A' ' 18' ' ' ILE . 7.1 tmtm? -56.56 -35.98 68.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 0.0 110.274 179.99 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.8 tt -65.39 1.92 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 121.006 0.431 . . . . 0.0 110.232 -179.975 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.514 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 63.14 89.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.446 180.0 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -169.97 11.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.883 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -169.99 -143.79 4.05 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 -179.995 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.3 -87.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.749 0.309 . . . . 0.0 110.369 179.932 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.502 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -77.25 -47.42 20.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.235 179.765 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.6 mt -79.81 70.08 6.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.473 179.872 . . . . . . . . 1 1 . 1 . 084 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.453 ' OD2' ' N ' ' A' ' 25' ' ' HIS . 58.4 p-10 -167.47 -14.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.387 -179.968 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.453 ' N ' ' OD2' ' A' ' 24' ' ' ASP . 12.8 t-80 -74.06 101.79 4.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 -179.943 . . . . . . . . 2 2 . 1 . 084 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.495 179.861 . . . . . . . . 0 0 . 1 . 085 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 085 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -169.61 59.2 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.319 179.998 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 57.8 mtp180 -50.26 -39.61 45.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.811 -179.853 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 61.3 tttp -156.44 64.67 0.54 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.457 -179.796 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 78.0 mtt-85 42.61 -91.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.98 179.909 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.507 ' C ' ' H ' ' A' ' 8' ' ' LEU . 66.8 mmtt -123.18 -178.32 3.94 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.935 179.698 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.9 t90 58.38 3.47 0.27 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 179.861 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.544 ' CD1' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -56.54 -83.68 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.697 . . . . . . . . 3 3 . 1 . 085 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.544 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 15.1 mmm180 -140.08 19.6 2.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.994 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.433 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 1.3 ptp180 -47.23 -88.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.371 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.433 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 18.4 tt -82.46 -14.64 12.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.879 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.44 -39.86 84.82 Favored Glycine 0 C--N 1.334 0.428 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 179.494 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -50.88 -13.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.173 0.511 . . . . 0.0 109.934 178.913 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.488 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -102.99 -42.06 2.16 Favored Glycine 0 C--N 1.335 0.506 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.54 -179.866 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.432 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.5 m -105.6 -40.23 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 116.927 0.363 . . . . 0.0 111.169 -179.454 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.0 tttp -69.67 -28.3 65.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.731 0.3 . . . . 0.0 111.049 -179.723 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.8 tt -50.11 -20.85 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.969 -179.578 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 6.5 tp -155.01 -46.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.563 179.829 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 164.75 -28.54 0.21 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 121.064 -0.589 . . . . 0.0 112.103 -179.972 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.32 -51.5 4.18 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.055 -179.92 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.04 -47.68 61.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.751 0.31 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.1 -36.8 61.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.51 -179.972 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.52 53.59 1.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 -179.943 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -163.4 -60.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.489 -179.931 . . . . . . . . 1 1 . 1 . 085 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 51.52 59.51 4.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.528 179.97 . . . . . . . . 2 2 . 1 . 085 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.022 -179.954 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 086 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.47 ' C ' ' H ' ' A' ' 4' ' ' LYS . 39.9 ttm180 -169.48 -27.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.788 0.328 . . . . 0.0 110.538 -179.988 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -76.41 40.04 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.631 179.987 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.47 ' H ' ' C ' ' A' ' 2' ' ' ARG . 17.2 tptp -168.63 -21.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.491 179.973 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -59.61 -64.29 1.0 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.424 179.892 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.492 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 78.7 mttt -145.53 59.42 1.27 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.094 -180.0 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 97.5 m95 -159.89 2.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.02 -179.887 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.447 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -49.38 -85.07 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.174 -179.919 . . . . . . . . 3 3 . 1 . 086 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.447 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -158.88 18.47 0.19 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.902 179.784 . . . . . . . . 3 3 . 1 . 086 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -44.66 -89.38 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.394 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 tp -77.39 -19.33 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.14 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.85 -38.93 90.61 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 179.548 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -48.34 -17.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.113 0.483 . . . . 0.0 110.042 179.084 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.24 -43.36 2.58 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.36 -179.834 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.7 m -105.12 -42.45 7.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 116.845 0.323 . . . . 0.0 110.999 -179.517 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . 81.4 tttt -59.8 -40.35 88.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 0.0 110.43 -179.922 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.401 ' CG2' ' N ' ' A' ' 18' ' ' ILE . 17.1 tt -50.19 -43.32 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.555 -179.943 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.401 ' N ' ' CG2' ' A' ' 17' ' ' ILE . 13.7 mt -69.53 -65.04 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.107 179.74 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 173.64 52.26 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 179.884 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.77 -50.04 4.24 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.715 -0.554 . . . . 0.0 111.715 -179.753 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.98 31.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.705 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 61.14 40.55 14.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -177.403 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.453 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 8.4 mp 56.58 21.36 5.66 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.222 . . . . . . . . 2 2 . 1 . 086 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p30 42.73 37.52 1.07 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.972 -179.097 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.31 137.28 18.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.249 -1.341 . . . . 0.0 110.664 179.852 . . . . . . . . 1 1 . 1 . 086 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.453 179.99 . . . . . . . . 0 0 . 1 . 087 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 . . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -64.53 -3.26 2.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.808 0.337 . . . . 0.0 110.511 -179.994 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.437 ' H ' ' C ' ' A' ' 1' ' ' GLY . 50.6 mtp85 -58.93 -37.82 77.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.555 179.97 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -129.08 138.16 51.69 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.256 179.999 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -49.27 -72.49 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.65 -179.91 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -145.94 77.3 1.49 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.334 -179.98 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.457 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 58.1 t-105 -161.55 -8.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.293 -179.96 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.511 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.9 pt? -57.12 -159.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 179.924 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.17 30.03 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.123 0.487 . . . . 0.0 110.125 -179.867 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' A' ' 8' ' ' LEU . 10.7 ptt85 -38.53 -37.4 0.31 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.473 179.305 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.414 ' H ' ' H ' ' A' ' 12' ' ' GLY . 7.7 tt -137.24 -16.81 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.949 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.414 ' H ' ' H ' ' A' ' 11' ' ' ILE . . . -58.66 -27.82 61.92 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.818 179.059 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -54.45 -22.9 13.95 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.64 -46.97 3.58 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.957 -0.857 . . . . 0.0 110.957 179.26 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 46.7 t -92.6 -72.75 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.618 0.247 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.1 ttmt -35.79 -35.75 0.07 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.333 -179.252 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.4 tt -45.56 -14.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.731 0.3 . . . . 0.0 111.463 -179.581 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.495 ' N ' ' O ' ' A' ' 16' ' ' LYS . 17.9 tt -155.54 -26.85 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.547 179.783 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.02 4.08 33.47 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 179.78 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.499 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -161.61 -36.71 0.02 OUTLIER Glycine 0 C--N 1.33 0.238 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 179.947 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.71 8.08 1.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.95 0.405 . . . . 0.0 110.076 179.594 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -159.25 -39.92 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.157 -179.943 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -78.91 27.94 0.22 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.077 179.805 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.494 ' H ' ' C ' ' A' ' 22' ' ' ALA . 22.7 t70 -165.62 -26.63 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.342 -179.956 . . . . . . . . 2 2 . 1 . 087 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 58.79 105.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.684 179.838 . . . . . . . . 1 1 . 1 . 087 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 tt . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.155 179.929 . . . . . . . . 0 0 . 1 . 088 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.007 -0.437 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 088 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -79.09 60.78 3.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 110.604 179.967 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -54.89 -45.51 74.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' O ' ' N ' ' A' ' 6' ' ' LYS . 18.4 pttm -156.72 62.09 0.53 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.469 -179.924 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 60.4 -76.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.978 179.858 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 4' ' ' LYS . 81.8 mttt -142.45 -170.15 3.13 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.754 0.311 . . . . 0.0 110.463 -179.857 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.592 ' CE2' ' NH2' ' A' ' 9' ' ' ARG . 2.0 t90 69.2 -0.12 2.62 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.249 179.396 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.425 ' N ' ' CD2' ' A' ' 8' ' ' LEU . 0.8 OUTLIER -71.26 12.93 0.26 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.436 -179.727 . . . . . . . . 3 3 . 1 . 088 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.592 ' NH2' ' CE2' ' A' ' 7' ' ' TRP . 4.3 mmt-85 61.41 45.48 8.47 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.136 179.854 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -51.04 -86.83 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.699 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.5 pp -92.5 -7.73 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.383 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -62.59 -37.06 94.12 Favored Glycine 0 C--N 1.336 0.582 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.382 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.417 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 5.2 ttpm? -49.33 -15.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.959 0.409 . . . . 0.0 109.916 178.793 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -102.4 -42.39 2.2 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.571 -179.651 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -105.62 -40.36 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 116.823 0.311 . . . . 0.0 110.893 -179.529 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.9 tptt -67.93 -32.53 73.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.657 -179.911 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.5 tp -47.02 -55.47 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.521 -179.811 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.3 mt -89.31 -72.92 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.342 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.501 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -172.18 -14.78 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.077 -179.988 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.71 -34.22 1.01 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 121.207 -0.52 . . . . 0.0 112.009 -179.985 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.501 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -50.16 -44.56 52.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.87 0.367 . . . . 0.0 110.234 179.875 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.42 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -69.06 -47.98 63.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.076 179.588 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.6 mt -79.83 39.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.42 ' H ' ' C ' ' A' ' 22' ' ' ALA . 37.2 t0 -165.77 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -179.951 . . . . . . . . 2 2 . 1 . 088 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.0 m80 -76.49 84.44 3.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.536 -179.977 . . . . . . . . 1 1 . 1 . 088 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.492 179.817 . . . . . . . . 0 0 . 1 . 089 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 089 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.9 mtt-85 -64.63 80.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.803 0.335 . . . . 0.0 110.508 179.981 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.497 ' C ' ' H ' ' A' ' 5' ' ' ARG . 41.9 ttp180 -74.2 -61.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.637 -179.898 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 6' ' ' LYS . 86.2 mttt -78.25 30.96 0.18 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.621 -179.967 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.497 ' H ' ' C ' ' A' ' 3' ' ' ARG . 84.6 mtm180 54.15 -83.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.744 179.99 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 4' ' ' LYS . 88.5 mttt -141.82 74.28 1.45 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.474 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 73.5 t-105 -169.72 13.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.469 -179.954 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.442 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -73.58 -87.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.89 179.739 . . . . . . . . 3 3 . 1 . 089 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -168.27 25.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.355 179.94 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -47.5 -90.39 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.744 179.4 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.2 pt -85.46 -14.62 10.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.272 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -53.64 -44.87 68.99 Favored Glycine 0 C--N 1.331 0.287 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -45.39 -17.1 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.962 0.411 . . . . 0.0 110.327 178.925 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -101.97 -42.55 2.24 Favored Glycine 0 C--N 1.336 0.578 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.792 -179.725 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.7 m -104.2 -40.26 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 117.226 0.513 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 18' ' ' ILE . 53.1 tttp -56.53 -58.05 9.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.807 0.337 . . . . 0.0 110.658 -179.776 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.3 tt -77.41 20.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-O 121.173 0.511 . . . . 0.0 110.342 -179.675 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.48 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.5 mt 58.92 100.38 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.28 -179.976 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.07 -116.85 0.39 Allowed Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -179.963 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.585 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 53.18 175.13 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.804 -0.712 . . . . 0.0 111.829 179.644 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.487 ' O ' ' CB ' ' A' ' 22' ' ' ALA . . . -60.41 -1.7 0.39 Allowed 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.367 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.585 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . 100.52 79.35 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.758 -179.925 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt 45.46 49.04 10.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.094 -179.157 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -159.13 3.29 0.09 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.311 -1.313 . . . . 0.0 107.774 -179.41 . . . . . . . . 1 1 . 1 . 089 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.421 ' HB2' ' H ' ' A' ' 21' ' ' ALA . 10.3 t60 -78.21 -70.77 0.46 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.948 -179.058 . . . . . . . . 2 2 . 1 . 089 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.488 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.1 -179.797 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 111.932 -0.467 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 090 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -167.36 52.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.763 0.316 . . . . 0.0 110.363 -179.965 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -66.43 -25.22 66.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.71 -179.96 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 6' ' ' LYS . 82.9 tttt -163.86 61.67 0.16 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.429 -179.672 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 40.41 -91.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.112 179.878 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 4' ' ' LYS . 43.3 mtmt -115.9 170.56 8.38 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.934 179.598 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.513 ' C ' ' H ' ' A' ' 9' ' ' ARG . 1.9 m0 61.45 9.78 2.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.948 179.786 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.542 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.8 pt? -72.62 22.68 0.06 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.394 -179.934 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.513 ' H ' ' C ' ' A' ' 7' ' ' TRP . 0.8 OUTLIER 52.64 48.19 23.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.982 . . . . . . . . 3 3 . 1 . 090 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.534 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 8.4 ptm180 -57.91 -55.67 31.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.17 179.644 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.534 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 15.1 tt -119.97 -16.34 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.874 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.494 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.64 -34.36 60.44 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 178.938 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -49.66 -18.65 0.48 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.267 0.556 . . . . 0.0 109.814 178.989 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.434 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.91 -47.67 1.87 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.358 -179.731 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.29 -41.06 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 116.997 0.399 . . . . 0.0 111.366 -179.457 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.524 ' C ' ' H ' ' A' ' 18' ' ' ILE . 8.6 tmtm? -61.08 -36.26 79.17 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.943 179.974 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.66 -2.14 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.044 0.45 . . . . 0.0 110.104 179.672 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.524 ' H ' ' C ' ' A' ' 16' ' ' LYS . 10.0 mt 63.84 84.31 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.251 -179.78 . . . . . . . . 2 2 . 1 . 090 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -160.46 25.32 0.28 Allowed Glycine 0 C--N 1.331 0.256 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.784 179.996 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 -46.45 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.871 179.981 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.97 -63.91 0.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.815 0.341 . . . . 0.0 110.379 179.978 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.77 -40.29 91.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.347 179.933 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.3 mt -79.89 43.37 0.59 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -163.98 -32.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 -179.965 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.1 t60 54.84 105.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.589 -179.917 . . . . . . . . 1 1 . 1 . 090 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.358 -179.986 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 091 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 58.9 52.11 6.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.87 0.367 . . . . 0.0 110.293 -179.901 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -74.85 -24.08 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.578 -179.921 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 pttm -164.2 79.69 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.387 -179.88 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 54.71 -91.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.727 179.889 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -167.73 91.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.065 0.46 . . . . 0.0 110.596 -179.764 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.482 ' C ' ' H ' ' A' ' 9' ' ' ARG . 38.4 t90 -162.4 -4.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.152 179.708 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.433 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.0 OUTLIER -69.81 8.79 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 179.986 . . . . . . . . 3 3 . 1 . 091 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.482 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.3 mmt85 62.91 45.54 5.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.076 179.688 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -51.14 -88.05 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.566 . . . . . . . . 3 3 . 1 . 091 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.41 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 2.4 pp -98.37 -3.43 9.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.142 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -62.93 -34.95 91.3 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 178.822 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -51.04 -21.47 1.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.061 -0.57 . . . . 0.0 109.767 178.733 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.28 -36.4 5.43 Favored Glycine 0 C--N 1.333 0.413 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.636 -179.508 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.6 m -115.7 -44.88 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.055 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' C ' ' H ' ' A' ' 18' ' ' ILE . 35.4 ttmt -53.65 -54.11 42.42 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.805 -179.381 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.9 tt -69.01 5.55 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 -179.84 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.508 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.5 mt 60.47 81.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.316 179.978 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.46 83.11 0.78 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.167 -0.539 . . . . 0.0 112.026 -179.973 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.488 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -54.98 -14.69 5.82 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.11 -0.566 . . . . 0.0 111.838 179.93 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.65 19.61 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 179.947 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.488 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.05 -46.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.316 -179.958 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.3 mt -80.2 57.59 2.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.458 179.861 . . . . . . . . 1 1 . 1 . 091 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.494 ' C ' ' H ' ' A' ' 26' ' ' LEU . 26.0 t0 -167.67 2.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.557 179.996 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.418 ' H ' ' H ' ' A' ' 24' ' ' ASP . 1.9 m-70 -76.37 20.28 0.22 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.647 179.921 . . . . . . . . 2 2 . 1 . 091 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 24' ' ' ASP . 2.5 mm? . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.058 -179.965 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 092 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -168.28 50.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.918 0.389 . . . . 0.0 110.249 -179.945 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.411 ' NH2' ' HZ3' ' A' ' 4' ' ' LYS . 23.2 mtp-105 -78.63 -13.19 59.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.661 -179.89 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 39.8 mttm -145.3 50.24 1.23 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.527 -179.903 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 51.04 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.981 179.669 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 51.5 mtmt -141.79 71.97 1.37 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.418 -179.709 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.0 m-90 -159.89 10.25 0.11 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.522 179.885 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.559 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.32 -70.48 0.09 Allowed 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.93 . . . . . . . . 3 3 . 1 . 092 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.12 18.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.11 179.766 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 2.9 ptm85 -39.32 -90.21 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.438 179.761 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.402 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 1.8 pp -94.2 0.29 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.748 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -65.46 -41.66 96.24 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 179.217 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -47.06 -18.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.133 0.492 . . . . 0.0 110.215 179.155 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.46 -40.39 3.94 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.315 -179.957 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.6 m -111.1 -42.04 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.814 0.307 . . . . 0.0 111.745 -179.181 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.7 tttp -49.07 -61.77 1.89 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.188 -179.412 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 23.9 pt -73.39 15.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.893 -179.765 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.502 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.7 mt 59.41 108.69 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.389 179.975 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.49 -94.33 0.1 OUTLIER Glycine 0 C--N 1.33 0.21 0 C-N-CA 121.289 -0.481 . . . . 0.0 111.91 -179.906 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.501 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -67.54 -161.46 1.57 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.012 -179.912 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 54.73 9.7 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 0.0 110.302 -179.704 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.501 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.33 -58.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.179 -179.955 . . . . . . . . 2 2 . 1 . 092 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 mt -93.67 58.5 2.71 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.413 179.693 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -166.42 0.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.549 -179.991 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -54.11 140.15 32.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.596 179.96 . . . . . . . . 1 1 . 1 . 092 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.504 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 7.8 mp . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.061 -179.998 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 . . . . . . . . . 0 0 . 1 . 093 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -75.19 -11.02 59.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.851 0.357 . . . . 0.0 110.58 -179.986 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.506 HH22 HH22 ' A' ' 9' ' ' ARG . 89.4 mtm180 53.65 -101.17 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 093 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -102.37 48.82 0.86 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.71 -179.763 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 91.9 mtm180 51.92 -98.22 0.07 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.795 179.686 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 93.6 mttt -141.08 80.87 1.76 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.064 -179.943 . . . . . . . . 2 2 . 1 . 093 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 89.2 m95 -159.45 -10.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.493 -179.829 . . . . . . . . 2 2 . 1 . 093 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.417 ' CD2' ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -53.02 -92.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -180.0 . . . . . . . . 3 3 . 1 . 093 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.506 HH22 HH22 ' A' ' 3' ' ' ARG . 0.0 OUTLIER -171.61 22.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.866 179.835 . . . . . . . . 3 3 . 1 . 093 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -44.73 -89.81 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.77 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.1 tp -80.19 -17.18 12.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.947 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.535 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.92 -37.1 90.51 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 179.11 . . . . . . . . 2 2 . 1 . 093 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -50.64 -17.98 0.62 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.747 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.422 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -94.93 -43.65 3.51 Favored Glycine 0 C--N 1.334 0.461 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.268 -179.859 . . . . . . . . 2 2 . 1 . 093 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -107.11 -43.53 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 116.704 0.252 . . . . 0.0 110.994 -179.53 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' A' ' 12' ' ' GLY . 39.8 tptt -57.57 -33.32 68.04 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.374 -179.93 . . . . . . . . 2 2 . 1 . 093 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.8 tp -58.26 -6.58 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 109.724 179.614 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.502 ' H ' ' C ' ' A' ' 16' ' ' LYS . 7.0 mt 67.47 82.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.239 179.887 . . . . . . . . 2 2 . 1 . 093 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.85 -54.27 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.864 179.932 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -67.06 -38.11 92.29 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 121.289 -0.481 . . . . 0.0 111.973 -179.972 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 -48.83 67.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 110.595 -179.952 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.59 -17.26 63.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 -179.974 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 tp -64.14 -16.5 62.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.217 -179.965 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -158.6 61.26 0.43 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.405 -179.977 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -53.92 154.22 4.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 093 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 7.6 mp . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.094 179.976 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 094 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -166.26 128.73 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.877 0.37 . . . . 0.0 110.635 179.97 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' CD ' ' N ' ' A' ' 3' ' ' ARG . 11.2 mpt_? -92.72 -50.21 5.7 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.046 179.998 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -145.29 -10.64 0.55 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.242 -179.866 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 59.18 115.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.93 179.809 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 50.7 mtmt 46.53 43.1 11.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.343 179.457 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 2.4 m-90 -168.3 11.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.276 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.464 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -82.02 -10.58 59.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.796 179.928 . . . . . . . . 3 3 . 1 . 094 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 65.62 32.95 8.84 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.084 179.557 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -45.44 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.634 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.5 tt -87.0 -16.22 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.781 179.036 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.42 -37.45 66.28 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.045 -0.597 . . . . 0.0 111.697 179.689 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.31 -15.06 0.2 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.953 0.406 . . . . 0.0 110.064 179.389 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.475 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -103.42 -43.2 1.89 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.47 -179.912 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -104.8 -39.92 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.862 0.331 . . . . 0.0 111.042 -179.514 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' A' ' 12' ' ' GLY . 19.6 tptp -68.46 -31.86 71.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.434 179.962 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.4 tt -49.57 -24.81 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.677 -179.802 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.4 mm -138.5 -73.2 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.405 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.483 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -179.32 -20.37 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.197 -179.984 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.505 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 75.61 -20.88 2.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 121.164 -0.541 . . . . 0.0 111.944 179.997 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -65.57 1.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.935 0.397 . . . . 0.0 110.486 179.89 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.505 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -140.08 -48.32 0.45 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.092 179.902 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.8 tp -77.06 64.2 2.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.183 179.765 . . . . . . . . 1 1 . 1 . 094 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.42 ' H ' ' H ' ' A' ' 25' ' ' HIS . 32.7 t0 -166.9 -8.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 -179.856 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.42 ' H ' ' H ' ' A' ' 24' ' ' ASP . 11.8 t60 -70.65 -45.45 65.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.612 -179.847 . . . . . . . . 2 2 . 1 . 094 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.456 -179.994 . . . . . . . . 0 0 . 1 . 095 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.446 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.1 mmt180 -69.14 2.4 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.311 . . . . 0.0 110.529 179.94 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.446 ' H ' ' C ' ' A' ' 1' ' ' GLY . 51.3 mtp85 -56.32 -16.11 5.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.499 179.956 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -146.4 141.02 26.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 179.714 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -50.21 -66.9 0.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 -179.673 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -144.14 76.88 1.53 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.56 -179.703 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.409 ' H ' ' H ' ' A' ' 8' ' ' LEU . 66.0 t-105 -171.24 7.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.306 179.783 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.439 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -65.23 -86.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.905 179.746 . . . . . . . . 3 3 . 1 . 095 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.402 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -152.63 12.52 0.53 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.924 0.392 . . . . 0.0 110.502 179.61 . . . . . . . . 3 3 . 1 . 095 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.587 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 16.8 ptt85 -43.06 -60.12 1.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.096 179.846 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.587 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 1.2 mm -116.02 -16.25 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.353 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.509 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.24 -34.62 67.78 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.021 179.252 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -54.2 -12.48 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.966 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -103.21 -46.93 1.38 Allowed Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.995 -179.964 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.2 m -101.19 -39.03 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 116.716 0.258 . . . . 0.0 111.041 -179.624 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.0 tttt -69.71 -25.6 63.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.916 -179.778 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.7 tt -43.53 -23.57 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.774 0.321 . . . . 0.0 111.278 -179.939 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.412 ' CG2' ' N ' ' A' ' 19' ' ' GLY . 16.1 tt -156.17 -43.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.541 -179.976 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.483 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 166.85 -20.55 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.177 -0.535 . . . . 0.0 111.842 -179.935 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.17 -21.74 1.7 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.483 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -68.01 -46.95 69.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.821 0.343 . . . . 0.0 110.323 179.908 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.89 -38.81 44.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.468 179.888 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 12.2 tp -76.04 70.14 2.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.416 -179.938 . . . . . . . . 1 1 . 1 . 095 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' H ' ' H ' ' A' ' 25' ' ' HIS . 29.7 p30 -173.16 -10.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.457 179.892 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.428 ' H ' ' H ' ' A' ' 24' ' ' ASP . 3.1 p-80 -51.08 156.09 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.554 -179.891 . . . . . . . . 2 2 . 1 . 095 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.491 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.194 -179.964 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 096 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.5 mtt85 -56.18 120.59 7.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.771 0.319 . . . . 0.0 110.587 179.977 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -165.46 -39.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.393 179.923 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -120.66 45.15 2.3 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.836 179.89 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.7 tpp180 47.99 42.85 17.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.466 -179.778 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 50.95 81.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.474 -179.839 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.429 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 73.1 t-105 -166.13 14.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.739 -179.836 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.499 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -77.39 -93.59 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.214 179.824 . . . . . . . . 3 3 . 1 . 096 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.499 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 32.2 mmt-85 -141.41 14.67 2.19 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.811 -179.327 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 4.5 ptm180 -47.48 -87.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.822 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.465 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.2 tp -80.96 -14.36 12.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.04 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -49.33 -52.21 24.06 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.872 179.736 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 mtmm -44.18 -17.76 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.875 0.369 . . . . 0.0 110.678 179.474 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -98.71 -31.32 6.4 Favored Glycine 0 C--N 1.332 0.322 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.425 -179.816 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 12' ' ' GLY . 16.2 m -119.92 -44.02 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 116.967 0.384 . . . . 0.0 111.215 -179.595 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 12' ' ' GLY . 37.4 tptt -53.64 -57.76 9.63 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.428 -179.894 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 tp -74.81 14.04 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.361 -179.891 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.484 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.3 mt 56.68 81.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.377 -179.869 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -66.27 98.48 0.38 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.951 179.94 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.497 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -66.72 -12.07 58.65 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.075 -179.961 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.93 10.89 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 110.57 179.983 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.497 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.25 -45.74 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 -179.959 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 7.2 mp -78.64 48.51 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.063 179.971 . . . . . . . . 2 2 . 1 . 096 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -165.1 -55.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.505 -179.963 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 14.3 t-80 54.34 77.36 0.2 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.511 -179.992 . . . . . . . . 1 1 . 1 . 096 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.389 179.834 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 N-CA-C 111.94 -0.464 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 097 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.9 mtm-85 -52.42 130.15 30.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.513 -179.892 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.41 -36.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.356 179.979 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -141.67 53.82 1.51 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.0 0.429 . . . . 0.0 110.005 179.834 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mmt180 48.42 29.31 1.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.605 -179.868 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.6 mttm 54.88 95.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.375 -179.776 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.477 ' C ' ' H ' ' A' ' 9' ' ' ARG . 58.1 t90 -164.81 -13.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.464 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.95 -12.17 0.54 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.991 . . . . . . . . 3 3 . 1 . 097 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.477 ' H ' ' C ' ' A' ' 7' ' ' TRP . 3.3 tpp85 76.08 31.31 0.67 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.356 -179.81 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.1 ptt85 -50.02 -90.73 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.35 -0.386 . . . . 0.0 109.963 179.512 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.8 tt -80.86 -21.83 11.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.214 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.486 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -54.91 -40.11 71.26 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.778 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -50.13 -15.11 0.19 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.189 0.519 . . . . 0.0 109.832 178.947 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -100.0 -43.04 2.5 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.53 -179.773 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.3 m -104.35 -42.36 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 117.002 0.401 . . . . 0.0 111.324 -179.437 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' C ' ' H ' ' A' ' 18' ' ' ILE . 1.1 tmtm? -52.92 -62.32 1.73 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.04 -179.863 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.7 tt -72.09 8.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.164 0.507 . . . . 0.0 109.791 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.515 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.1 mm 60.94 94.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.018 -179.849 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -65.33 138.87 39.06 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.092 -179.834 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.25 -28.02 71.58 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.079 -0.581 . . . . 0.0 111.911 179.892 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.58 -55.86 19.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.856 0.36 . . . . 0.0 110.421 179.801 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.1 -46.16 65.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.381 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.1 tp -77.97 67.08 3.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.271 179.87 . . . . . . . . 1 1 . 1 . 097 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' H ' ' H ' ' A' ' 25' ' ' HIS . 27.3 t70 -166.74 -8.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.382 179.985 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.406 ' H ' ' H ' ' A' ' 24' ' ' ASP . 18.6 m-70 -74.79 -2.64 27.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.481 -179.975 . . . . . . . . 2 2 . 1 . 097 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.442 179.976 . . . . . . . . 0 0 . 1 . 098 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 098 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.0 mtm180 -149.74 -37.41 0.15 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.855 0.359 . . . . 0.0 110.212 179.918 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 51.15 -100.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 179.95 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -83.88 -78.25 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.748 -0.205 . . . . 0.0 110.628 -179.737 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 55.5 ttt180 -173.39 -56.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.745 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.461 ' C ' ' H ' ' A' ' 8' ' ' LEU . 70.0 mmtt -133.69 156.63 47.57 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.727 179.54 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.42 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 59.7 t-105 60.76 3.2 0.59 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 179.616 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.483 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -46.04 -86.59 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.81 0.338 . . . . 0.0 110.259 179.558 . . . . . . . . 3 3 . 1 . 098 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.483 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 6.1 tpt180 -160.81 25.4 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.941 179.768 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -49.65 -89.24 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.87 179.613 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.2 pt -85.1 -14.09 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.308 179.579 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.4 -46.69 71.84 Favored Glycine 0 CA--C 1.508 -0.398 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -44.84 -20.06 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.124 0.488 . . . . 0.0 109.773 178.438 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -91.02 -45.53 4.14 Favored Glycine 0 C--N 1.333 0.417 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.294 179.908 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 28.5 m -109.79 -42.46 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 117.112 0.456 . . . . 0.0 111.135 -179.696 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.523 ' N ' ' O ' ' A' ' 12' ' ' GLY . 80.7 tttt -59.05 -27.35 65.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.221 179.955 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.0 tt -64.46 -4.03 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.867 179.606 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.0 mm 63.21 66.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.206 -179.695 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -118.39 51.48 0.75 Allowed Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.707 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.487 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 65.32 8.08 35.81 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 -179.445 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.54 13.42 0.2 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.053 0.454 . . . . 0.0 110.159 -179.651 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.487 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.2 3.84 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.94 179.952 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.409 ' H ' ' H ' ' A' ' 22' ' ' ALA . 8.0 tp -122.86 55.86 1.17 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.552 179.649 . . . . . . . . 2 2 . 1 . 098 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -138.44 -51.25 0.57 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.134 -179.658 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -77.24 101.16 6.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.547 179.901 . . . . . . . . 1 1 . 1 . 098 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.126 179.962 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.254 0 N-CA-C 111.902 -0.479 . . . . 0.0 111.902 . . . . . . . . . 0 0 . 1 . 099 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -68.54 85.34 0.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.839 0.352 . . . . 0.0 110.569 179.954 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -59.35 -41.26 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -145.51 47.85 1.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 -179.721 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.45 66.36 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.639 -179.93 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 62.1 mttm 56.38 -160.15 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 -179.898 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 96.0 m95 55.15 14.9 1.1 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.427 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.43 -70.73 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.831 0.348 . . . . 0.0 110.079 -179.986 . . . . . . . . 3 3 . 1 . 099 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -167.33 14.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.363 -179.896 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.3 ptt180 -42.72 -88.45 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.892 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.8 tt -87.22 -13.52 10.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 178.975 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.488 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.88 -36.91 75.23 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 110.786 -0.925 . . . . 0.0 110.786 179.462 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.24 -16.09 0.09 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.042 0.449 . . . . 0.0 110.077 178.781 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.48 -45.26 1.46 Allowed Glycine 0 C--N 1.336 0.537 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.493 -179.83 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.4 m -101.41 -39.2 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 117.014 0.407 . . . . 0.0 111.198 -179.55 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 12' ' ' GLY . 11.9 ttmm -70.72 -33.43 70.84 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.633 -179.857 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.7 tt -48.14 -26.57 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.832 0.348 . . . . 0.0 110.444 179.965 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.4 mt -135.39 -79.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.128 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.08 50.95 0.01 OUTLIER Glycine 0 C--N 1.332 0.324 0 N-CA-C 111.804 -0.519 . . . . 0.0 111.804 179.951 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 48.67 -137.08 17.38 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.195 -0.526 . . . . 0.0 111.834 -179.874 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.51 15.08 0.19 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.888 0.375 . . . . 0.0 110.426 179.99 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -171.64 -65.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.351 -179.932 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.4 mm? -79.64 59.7 3.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.116 179.821 . . . . . . . . 2 2 . 1 . 099 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -165.9 -9.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.641 -179.964 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -68.73 163.99 22.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.98 . . . . . . . . 1 1 . 1 . 099 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.512 179.948 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 100 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 4' ' ' LYS . 70.3 mtm180 -60.61 -73.27 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.488 -179.991 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.0 ttt-85 60.33 -77.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.693 -179.948 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 6' ' ' LYS . 49.4 mttm -104.36 38.07 1.96 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.68 0.276 . . . . 0.0 110.528 179.928 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 53.51 -85.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.617 179.934 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' LYS . 54.4 mttm -145.71 58.29 1.24 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.207 -179.947 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.475 ' C ' ' H ' ' A' ' 9' ' ' ARG . 93.5 m95 -147.39 18.75 1.2 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.683 179.81 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.35 24.26 0.45 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.652 179.6 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.475 ' H ' ' C ' ' A' ' 7' ' ' TRP . 7.0 tpp180 71.06 33.44 2.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.33 179.442 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ptt85 -51.97 -91.9 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.741 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.7 pt -79.75 -11.21 12.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.292 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -51.69 -54.39 25.09 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.607 179.9 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -44.56 -18.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.077 0.465 . . . . 0.0 110.026 178.919 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -95.09 -32.77 6.91 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.733 -179.845 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.419 ' N ' ' O ' ' A' ' 12' ' ' GLY . 33.1 m -126.9 -42.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 117.486 0.643 . . . . 0.0 112.008 -179.071 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' C ' ' H ' ' A' ' 18' ' ' ILE . 18.4 mmmt -54.4 -54.46 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.64 -179.239 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.0 tt -65.56 0.34 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.099 0.476 . . . . 0.0 109.978 179.766 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.503 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.7 mt 62.51 100.87 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.483 179.809 . . . . . . . . 2 2 . 1 . 100 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.42 -74.43 0.02 OUTLIER Glycine 0 C--N 1.33 0.221 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.83 179.997 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.55 -29.06 74.16 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.84 179.884 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.18 -58.97 6.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 110.543 179.951 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.55 -38.88 70.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.526 179.911 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tp -76.09 68.31 2.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.463 -179.958 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -166.92 -28.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.487 179.922 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -67.13 -56.69 8.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.455 179.942 . . . . . . . . 1 1 . 1 . 100 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.5 mt . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.437 179.867 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 N-CA-C 111.99 -0.444 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -165.93 19.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.395 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 tpp85 -56.47 -28.86 60.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.435 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -147.29 146.57 29.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.311 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.06 85.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.571 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 49.04 72.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.745 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 61.3 t-105 -167.19 0.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.732 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.552 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.47 -68.67 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.856 0.36 . . . . 0.0 110.139 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -171.68 16.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.286 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -48.14 -87.14 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.7 pt -89.8 -12.48 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.85 -41.15 66.51 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -45.52 -16.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.054 0.454 . . . . 0.0 110.576 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -103.64 -42.15 2.04 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.513 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -105.63 -40.37 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 116.939 0.369 . . . . 0.0 111.258 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 12' ' ' GLY . 81.7 tttt -59.37 -51.03 71.66 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.904 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 tp -74.98 14.86 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.095 0.474 . . . . 0.0 110.101 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.5 mt 62.11 108.44 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.517 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.07 -87.65 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.851 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.65 -20.1 79.77 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.897 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.29 -64.83 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.726 0.298 . . . . 0.0 110.628 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.25 89.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.465 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.436 ' C ' ' H ' ' A' ' 25' ' ' HIS . 12.6 mt -82.31 -156.44 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 53.25 9.89 0.17 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.826 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.436 ' H ' ' C ' ' A' ' 23' ' ' LEU . 89.9 m-70 -155.34 53.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.573 -179.118 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.9 ptt85 -171.86 52.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.825 0.345 . . . . 0.0 110.526 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -52.92 -13.52 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.589 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -161.68 61.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.365 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 47.3 -175.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -79.88 65.5 5.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.403 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' C ' ' H ' ' A' ' 9' ' ' ARG . 98.9 m95 -151.65 -2.27 0.31 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.98 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -68.06 8.39 0.42 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.05 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 7' ' ' TRP . 9.7 mmt-85 63.17 47.49 4.1 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.018 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 -52.87 -83.38 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.3 tt -87.96 -16.64 8.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.35 -39.8 83.82 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.453 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -49.54 -15.53 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.114 0.483 . . . . 0.0 109.886 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.454 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.48 -44.26 2.18 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.447 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.38 -41.66 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 116.979 0.389 . . . . 0.0 111.038 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 2.9 tppp? -59.1 -38.04 78.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.507 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.52 HG23 ' H ' ' A' ' 18' ' ' ILE . 5.5 tp -50.06 -54.88 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.966 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.52 ' H ' HG23 ' A' ' 17' ' ' ILE . 3.2 pt -152.74 76.06 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.42 88.3 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.234 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . -53.09 -16.98 4.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.635 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.2 16.23 0.48 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.946 0.403 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.446 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -157.38 -51.64 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.544 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.7 mp -82.4 17.73 1.64 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.96 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -166.14 40.08 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.544 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -73.0 111.51 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.515 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.5 mt . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.522 -179.965 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.981 -0.447 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -73.44 73.92 1.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.761 0.315 . . . . 0.0 110.609 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -67.26 -46.35 73.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.533 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -169.66 73.19 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.574 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 52.65 175.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.625 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -75.52 91.64 2.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.218 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.443 ' C ' ' H ' ' A' ' 9' ' ' ARG . 59.1 t90 -169.69 -6.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.343 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.77 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -63.3 2.58 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.516 -179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.572 ' NH2' ' NZ ' ' A' ' 16' ' ' LYS . 20.5 mmt180 62.69 37.36 12.79 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 120.674 0.273 . . . . 0.0 110.663 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -48.11 -92.83 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.3 pt -88.16 -8.89 10.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.88 -39.71 97.27 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.214 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -51.17 -15.4 0.35 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.68 -40.76 3.53 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.314 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.437 HG23 ' N ' ' A' ' 16' ' ' LYS . 23.7 m -113.73 -42.85 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 116.805 0.303 . . . . 0.0 111.525 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.572 ' NZ ' ' NH2' ' A' ' 9' ' ' ARG . 85.2 tttt -51.17 -55.88 15.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.581 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.532 HG23 ' O ' ' A' ' 17' ' ' ILE . 3.4 tp -77.13 39.33 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.154 0.502 . . . . 0.0 110.022 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' H ' ' C ' ' A' ' 16' ' ' LYS . 23.8 pt 34.64 56.21 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.57 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.29 173.46 51.03 Favored Glycine 0 N--CA 1.453 -0.213 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.067 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -52.14 -19.39 5.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.898 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.11 -53.34 58.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 110.467 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.26 -40.8 64.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.6 mt -80.94 57.04 2.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.69 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 26' ' ' LEU . 30.2 t70 -171.27 -21.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.547 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -76.17 37.08 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.546 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.735 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 51.06 52.34 15.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.782 0.325 . . . . 0.0 110.606 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -69.23 -13.02 62.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.493 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -142.87 -78.11 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.384 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.8 tpp85 -171.16 59.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.381 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 52.0 64.8 1.71 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.478 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 32.3 t90 -171.77 10.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.513 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.578 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.06 -92.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -166.73 25.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.298 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 20.1 ptt-85 -46.16 -60.83 2.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.531 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.538 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 1.1 pt -117.67 -13.46 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.388 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.24 -34.01 72.41 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 178.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -50.73 -18.12 0.66 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.066 0.46 . . . . 0.0 109.837 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.49 -44.66 2.47 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.277 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.4 m -103.66 -42.02 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 116.792 0.296 . . . . 0.0 111.205 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.1 tttp -61.79 -31.55 71.78 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.549 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 tt -66.93 4.11 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 120.995 0.426 . . . . 0.0 110.072 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.1 mm 62.64 88.4 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.177 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.95 -64.98 0.02 OUTLIER Glycine 0 C--N 1.331 0.266 0 C-N-CA 121.105 -0.569 . . . . 0.0 111.959 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.69 83.81 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.119 -0.562 . . . . 0.0 111.998 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.6 -55.22 27.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.772 0.32 . . . . 0.0 110.546 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.31 -31.46 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.516 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.37 42.93 0.36 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.332 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -171.9 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 51.27 88.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.523 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.527 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.031 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.264 0 N-CA-C 111.953 -0.459 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 59.6 mtt-85 56.5 70.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.611 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -76.83 -31.92 57.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -162.18 37.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.439 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 54.31 93.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.481 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 3.8 mptp? 54.12 169.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.299 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.411 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 65.2 t-105 62.59 14.02 6.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.405 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -60.23 -81.41 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.1 16.67 0.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.234 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -40.46 -89.81 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.799 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -79.87 -19.22 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 110.081 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.596 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.14 -54.26 27.07 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.313 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.443 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 19.0 pttm -43.53 -19.01 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.338 -0.507 . . . . 0.0 110.432 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -92.6 -39.91 5.16 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.437 HG23 ' N ' ' A' ' 16' ' ' LYS . 15.4 m -112.93 -47.53 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.596 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.3 tttt -56.18 -37.61 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.443 ' CG2' ' O ' ' A' ' 13' ' ' LYS . 8.0 tt -51.73 -7.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.88 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.517 ' H ' ' C ' ' A' ' 16' ' ' LYS . 7.6 mt 70.15 66.95 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.006 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.21 129.22 8.9 Favored Glycine 0 C--N 1.332 0.308 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.952 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -74.44 -2.33 63.21 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.183 -0.532 . . . . 0.0 111.901 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.59 16.84 0.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.709 0.29 . . . . 0.0 110.577 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.404 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -168.1 -47.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.503 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.592 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.1 mp -78.76 51.11 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -164.17 -42.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -73.7 -20.53 60.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.448 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.83 33.87 0.22 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.328 . . . . 0.0 110.553 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -76.19 -18.33 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.654 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' A' ' 6' ' ' LYS . 61.5 tttp -166.81 71.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.88 0.371 . . . . 0.0 110.757 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.8 mtm-85 45.09 -93.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.117 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' N ' ' O ' ' A' ' 4' ' ' LYS . 79.5 mttt -145.8 77.4 1.5 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.552 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.486 ' CE3' ' O ' ' A' ' 7' ' ' TRP . 55.2 t90 -166.49 6.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.363 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.58 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.66 -73.25 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.264 -179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.34 13.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.188 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -39.75 -90.07 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.2 pt -82.82 -3.4 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -61.75 -47.37 90.75 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -43.13 -19.97 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.078 0.466 . . . . 0.0 110.249 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -93.83 -41.46 4.38 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.154 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.1 m -111.42 -43.15 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-N 116.908 0.354 . . . . 0.0 111.526 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 59.3 tttm -46.45 -52.03 13.95 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.811 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.9 mm -45.05 -59.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.686 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.5 tt -171.63 -17.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.76 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.79 63.41 5.12 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.835 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -167.81 -60.2 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 121.202 -0.523 . . . . 0.0 111.95 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.2 -65.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 110.466 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.55 66.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 tp -55.07 -19.73 7.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.165 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.474 ' O ' ' N ' ' A' ' 26' ' ' LEU . 22.3 t70 -160.29 61.02 0.34 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.395 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -49.18 90.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.655 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.474 ' N ' ' O ' ' A' ' 24' ' ' ASP . 31.3 tp . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.298 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.517 ' CZ ' HH12 ' A' ' 5' ' ' ARG . 52.3 mtp180 -74.24 -72.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.733 0.301 . . . . 0.0 110.573 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 51.24 -99.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.322 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -87.07 123.34 32.04 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.264 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.517 HH12 ' CZ ' ' A' ' 2' ' ' ARG . 23.9 mmt180 -51.97 97.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.325 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.2 pttp 32.45 80.91 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.729 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.494 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 55.9 t-105 -168.13 -6.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.927 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.62 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.7 pt? -75.17 21.09 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.29 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.409 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.8 mmt-85 62.27 39.67 12.23 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.819 0.343 . . . . 0.0 110.462 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' O ' ' O ' ' A' ' 9' ' ' ARG . 3.0 ptp180 -48.32 -93.4 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.3 pt -83.77 -7.18 10.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -64.83 -43.04 96.7 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.704 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -13.49 0.36 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.264 0.554 . . . . 0.0 109.551 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.47 -42.43 3.42 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.06 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.44 HG23 ' N ' ' A' ' 16' ' ' LYS . 23.6 m -112.93 -43.09 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 116.751 0.276 . . . . 0.0 111.031 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.7 tttt -57.76 -32.22 67.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.714 0.293 . . . . 0.0 110.611 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -67.23 3.01 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.2 mt 60.76 84.58 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.38 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.78 25.39 0.14 Allowed Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.841 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -167.79 -57.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.195 -0.526 . . . . 0.0 111.909 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.86 -54.0 34.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.786 0.327 . . . . 0.0 110.505 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.49 ' O ' ' NE2' ' A' ' 25' ' ' HIS . . . -65.89 -23.98 66.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.606 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 mt -84.24 65.06 8.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.488 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -160.16 -38.36 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.308 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.49 ' NE2' ' O ' ' A' ' 22' ' ' ALA . 13.0 p80 -77.01 131.3 38.37 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.104 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.265 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.486 ' O ' ' N ' ' A' ' 4' ' ' LYS . 67.6 mtp180 -69.92 -76.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.683 0.278 . . . . 0.0 110.57 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.4 mmt-85 59.3 -77.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 6' ' ' LYS . 6.1 ptmm? -158.28 70.13 0.53 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.018 0.437 . . . . 0.0 110.695 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 56.27 -79.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.059 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.504 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.7 mttm -140.04 -157.87 0.81 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.602 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' C ' ' H ' ' A' ' 9' ' ' ARG . 11.2 t-105 73.53 -29.51 0.2 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.909 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.65 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.9 pt? -51.1 -10.37 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.195 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 7' ' ' TRP . 12.3 tpp180 73.62 41.09 0.46 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.753 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -55.56 -91.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.8 pt -85.93 -13.79 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.15 -47.73 60.3 Favored Glycine 0 CA--C 1.508 -0.359 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.71 -20.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.308 0.575 . . . . 0.0 109.969 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -94.14 -44.19 3.6 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.549 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.3 m -104.19 -43.05 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 117.303 0.552 . . . . 0.0 111.037 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . 20.2 tptp -47.48 -68.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.981 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.4 ' O ' ' O ' ' A' ' 18' ' ' ILE . 20.3 pt -74.87 33.48 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.168 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.446 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 51.08 100.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.732 0.301 . . . . 0.0 110.555 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.38 130.07 46.14 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.926 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -49.45 135.51 23.52 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.624 -0.591 . . . . 0.0 111.624 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.13 20.77 1.9 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.928 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 56.84 45.56 21.35 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 24.4 mt 55.54 22.12 4.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -177.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 42.7 47.91 4.71 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.95 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.407 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 56.1 t60 -77.15 39.28 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.726 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 26' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.066 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -172.7 43.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.757 0.313 . . . . 0.0 110.724 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.606 HH22 ' HZ3' ' A' ' 4' ' ' LYS . 33.5 ttp85 -59.99 -49.27 78.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.242 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.606 ' HZ3' HH22 ' A' ' 3' ' ' ARG . 50.9 mttp -83.97 -79.14 0.21 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.463 . . . . 0.0 110.314 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -170.23 -80.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.994 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -154.36 55.14 0.69 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.913 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -151.76 -5.93 0.25 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.382 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -53.38 -85.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.759 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? -163.53 18.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.746 0.308 . . . . 0.0 111.004 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -44.15 -89.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.9 tp -77.23 -19.51 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.75 -40.86 89.88 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -46.37 -17.17 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.978 0.418 . . . . 0.0 110.461 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.46 -41.41 2.55 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.467 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -107.37 -41.08 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 116.824 0.312 . . . . 0.0 111.098 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 12' ' ' GLY . 40.6 tptt -66.67 -31.06 71.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.631 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.4 tt -45.28 -24.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.586 HG23 ' N ' ' A' ' 19' ' ' GLY . 16.9 tt -159.92 -48.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.796 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.586 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 159.07 3.31 0.07 OUTLIER Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.124 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 64.08 3.9 10.05 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.813 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.38 9.42 1.04 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.923 0.392 . . . . 0.0 110.404 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -160.87 -44.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.23 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.499 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.2 mm? -80.75 57.32 2.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.974 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.427 ' O ' HD23 ' A' ' 26' ' ' LEU . 30.3 t70 -167.99 -50.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -93.24 72.07 4.53 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.617 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' H ' HD23 ' A' ' 26' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.87 0.367 . . . . 0.0 110.121 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 111.932 -0.467 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 53.91 62.92 2.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.869 0.366 . . . . 0.0 110.508 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 60.2 mtp180 -85.3 -20.86 29.36 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.503 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -134.54 46.62 2.46 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.364 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 42.57 -108.82 0.11 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.078 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.488 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 65.5 mmtt -114.48 68.95 0.7 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.32 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.4 m-90 -154.52 -10.44 0.13 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.23 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.738 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -69.1 5.54 1.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.408 ' H ' ' C ' ' A' ' 7' ' ' TRP . 37.9 mmm-85 60.54 43.54 12.79 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.75 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -52.7 -89.06 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.6 pt -86.24 -10.07 11.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.453 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -60.52 -40.33 97.61 Favored Glycine 0 C--N 1.336 0.542 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -52.3 -13.01 0.29 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . -104.25 -42.15 1.95 Allowed Glycine 0 C--N 1.336 0.577 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.742 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.95 -39.7 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 117.184 0.492 . . . . 0.0 111.054 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.452 ' N ' ' O ' ' A' ' 12' ' ' GLY . 5.5 tmtt? -56.55 -64.48 0.85 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 tt -74.44 6.73 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 17.3 mt 62.08 109.25 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.475 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -173.9 -109.62 0.23 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.41 -110.5 0.6 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.051 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.52 97.34 0.78 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 58.51 56.65 4.2 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt 59.23 20.02 8.1 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -177.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 43.33 38.63 1.77 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-O 122.127 0.965 . . . . 0.0 109.452 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -72.13 0.07 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 113.665 -1.607 . . . . 0.0 110.939 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.471 -179.957 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 mtt-85 52.55 72.18 0.42 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.846 0.355 . . . . 0.0 110.434 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -57.06 -43.52 82.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.762 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.508 ' O ' ' N ' ' A' ' 6' ' ' LYS . 38.2 mttm -142.42 44.35 1.63 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.437 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 58.0 -78.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.549 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 4' ' ' LYS . 80.6 mttt -136.19 -164.21 1.52 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.189 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.457 ' C ' ' HE ' ' A' ' 9' ' ' ARG . 14.0 t90 72.9 -35.0 0.31 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.186 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.1 pt? -68.03 3.17 1.68 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.125 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.757 ' H ' ' HE ' ' A' ' 9' ' ' ARG . 4.1 mmp_? 55.68 50.99 13.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.84 0.353 . . . . 0.0 110.509 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.474 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 14.9 ptt-85 -49.26 -53.92 19.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.472 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.474 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 12.5 tt -121.48 -19.3 4.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.448 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -56.33 -35.74 66.79 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.047 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.91 -12.34 0.31 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.236 0.541 . . . . 0.0 109.737 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.78 -44.66 1.62 Allowed Glycine 0 C--N 1.334 0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.416 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.44 -41.86 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.991 0.396 . . . . 0.0 111.298 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' N ' ' O ' ' A' ' 12' ' ' GLY . 56.9 mttp -68.55 -34.39 75.75 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.229 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.465 HG23 ' N ' ' A' ' 18' ' ' ILE . 8.6 tp -50.56 -39.26 17.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.811 0.339 . . . . 0.0 110.44 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.465 ' N ' HG23 ' A' ' 17' ' ' ILE . 4.4 tp -103.28 -19.07 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.18 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -41.62 -26.72 0.27 Allowed Glycine 0 C--N 1.331 0.255 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.582 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.21 -57.5 3.65 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 121.197 -0.525 . . . . 0.0 111.932 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.45 -35.48 19.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.983 0.421 . . . . 0.0 110.127 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -84.72 -50.66 7.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.979 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.07 69.39 6.45 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.355 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -168.84 -36.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -71.84 81.04 0.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.546 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.636 -179.884 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 111.879 -0.489 . . . . 0.0 111.879 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.493 ' NE ' ' NZ ' ' A' ' 6' ' ' LYS . 75.4 ttt180 -54.38 -16.92 2.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.223 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.61 -16.0 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.79 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -86.04 11.05 12.49 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.87 0.367 . . . . 0.0 110.289 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 57.16 66.38 1.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.421 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.493 ' NZ ' ' NE ' ' A' ' 2' ' ' ARG . 62.6 mmtt 58.1 88.36 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.736 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.43 ' H ' ' H ' ' A' ' 8' ' ' LEU . 63.1 t-105 -169.36 -8.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.577 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.493 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -39.33 -70.67 0.1 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.768 179.804 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.75 8.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.833 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.452 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 4.2 ptm180 -33.43 -48.09 0.24 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.282 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.452 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 9.4 tt -126.35 -18.25 2.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.33 -37.74 82.85 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.96 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -51.47 -13.9 0.26 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.185 0.517 . . . . 0.0 109.741 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.15 -46.15 1.92 Allowed Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.194 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -104.54 -40.01 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 116.872 0.336 . . . . 0.0 111.219 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' A' ' 12' ' ' GLY . 54.0 tttm -60.08 -35.81 76.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.3 tp -70.07 4.05 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.981 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.414 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.6 mm 58.13 87.51 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.093 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.13 21.75 0.13 Allowed Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -172.38 -37.26 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.22 -78.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.305 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.16 -27.99 53.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.387 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.6 tp -78.52 53.8 1.36 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.486 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -170.28 -4.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.356 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -66.73 -75.24 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.566 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.51 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.2 mm? . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.083 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 4' ' ' LYS . 34.8 ptt85 -166.04 -34.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.81 0.338 . . . . 0.0 110.422 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.423 ' C ' ' H ' ' A' ' 5' ' ' ARG . 78.9 mtm180 48.9 -90.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.877 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 6' ' ' LYS . 86.1 mttt -77.21 36.08 0.18 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.762 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 3' ' ' ARG . 98.2 mtt180 57.14 -78.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.823 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 4' ' ' LYS . 15.1 ptpt -159.97 66.34 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.073 0.463 . . . . 0.0 110.183 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.476 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 75.6 t-105 -155.42 11.85 0.33 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.41 69.47 4.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.996 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 48.49 27.47 1.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.933 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -51.01 -89.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -83.88 -17.74 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.086 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.01 -46.27 69.81 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.194 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.3 -14.49 0.17 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.01 0.433 . . . . 0.0 110.047 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.55 -33.36 5.92 Favored Glycine 0 C--N 1.334 0.437 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.415 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.429 HG23 ' N ' ' A' ' 16' ' ' LYS . 25.7 m -122.58 -42.3 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 116.895 0.347 . . . . 0.0 111.044 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.8 tttt -56.67 -34.42 67.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.784 0.326 . . . . 0.0 110.431 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.8 tt -62.66 -1.0 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.46 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.8 mt 63.48 88.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.356 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.48 22.76 0.12 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.734 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -172.05 -23.72 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.98 11.75 0.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.937 0.399 . . . . 0.0 110.358 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.434 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.96 -44.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.161 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.8 mt -79.88 54.93 1.96 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.384 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 26' ' ' LEU . 24.0 t0 -162.65 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.387 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' ASP . 4.7 m80 -76.78 35.44 0.15 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.6 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 24' ' ' ASP . 14.8 mt . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.523 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 111.966 -0.453 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -73.37 74.4 1.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.729 0.299 . . . . 0.0 110.588 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 73.0 mtp180 -70.54 -62.34 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.542 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 80.2 mttt -96.73 49.12 1.08 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.685 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 53.63 -85.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.672 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' LYS . 92.9 mttt -142.88 78.41 1.61 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.278 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.481 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 77.0 t-105 -170.61 8.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.461 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -75.2 -92.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.051 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 11' ' ' ILE . 1.2 ppt_? -170.17 25.03 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.469 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.634 ' C ' ' H ' ' A' ' 12' ' ' GLY . 7.4 ptp180 -60.31 78.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.433 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.489 ' N ' ' O ' ' A' ' 9' ' ' ARG . 6.8 pt 55.77 -11.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.546 -178.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.634 ' H ' ' C ' ' A' ' 10' ' ' ARG . . . -72.55 -24.56 76.0 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -53.45 -15.76 1.19 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.426 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.22 -49.58 1.05 Allowed Glycine 0 C--N 1.337 0.602 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.652 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.6 m -96.63 -35.04 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 117.014 0.407 . . . . 0.0 111.538 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.459 ' N ' ' O ' ' A' ' 12' ' ' GLY . 61.4 tttm -76.87 -29.14 55.67 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.118 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.3 tp -55.13 -32.67 28.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.624 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.44 ' C ' ' H ' ' A' ' 20' ' ' GLY . 9.6 tt -167.54 -23.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.908 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.23 17.92 1.31 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.36 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -167.07 -47.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.87 2.25 1.51 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.915 0.388 . . . . 0.0 110.298 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -153.54 -38.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.227 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.6 tp -79.95 51.89 1.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.367 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.445 ' H ' ' H ' ' A' ' 25' ' ' HIS . 39.0 t70 -166.48 -9.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.66 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.445 ' H ' ' H ' ' A' ' 24' ' ' ASP . 38.4 t60 -70.0 -60.08 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.689 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.447 179.971 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.575 ' NH2' ' HZ1' ' A' ' 6' ' ' LYS . 54.7 mtp180 52.3 44.56 29.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.1 mtt85 -74.08 -2.34 24.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.656 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -161.68 71.24 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.588 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.5 mtm105 49.42 -108.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.665 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.575 ' HZ1' ' NH2' ' A' ' 2' ' ' ARG . 58.1 mttm -145.9 90.93 2.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.779 0.323 . . . . 0.0 110.223 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.486 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 30.7 t-105 -167.49 -14.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.765 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.566 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.55 -78.54 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.165 -179.677 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.507 ' O ' ' N ' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -177.37 18.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.574 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.632 ' C ' ' H ' ' A' ' 12' ' ' GLY . 4.6 ptp180 -57.5 78.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.313 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 9' ' ' ARG . 2.2 mm 61.72 -18.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.239 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.632 ' H ' ' C ' ' A' ' 10' ' ' ARG . . . -66.37 -30.4 76.57 Favored Glycine 0 N--CA 1.441 -1.012 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 178.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -52.43 -14.16 0.45 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.079 0.466 . . . . 0.0 109.786 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -108.53 -46.64 0.97 Allowed Glycine 0 C--N 1.337 0.595 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.569 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.4 m -99.19 -34.19 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 117.068 0.434 . . . . 0.0 111.518 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 12' ' ' GLY . 52.8 tttp -74.22 -39.7 62.93 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.03 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.1 tt -51.87 -37.57 21.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.298 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.27 -96.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 171.69 12.92 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.98 -10.07 3.42 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.866 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -66.57 -52.25 47.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 110.345 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.425 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -63.95 -34.42 77.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.427 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 tp -76.26 38.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.293 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' A' ' 22' ' ' ALA . 37.9 t70 -168.31 -58.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.575 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 51.14 56.33 8.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.508 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.7 mp . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.064 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.426 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.261 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.0 mtm-85 -76.32 36.16 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.585 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.426 ' H ' ' C ' ' A' ' 1' ' ' GLY . 61.8 mtt-85 -78.47 -29.47 46.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.642 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -144.55 23.11 1.62 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.434 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 57.21 65.45 1.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.577 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp 48.07 85.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.649 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.514 ' H ' HD23 ' A' ' 8' ' ' LEU . 41.9 t-105 -166.74 -19.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.574 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.711 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.7 pt? -52.05 -10.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 7' ' ' TRP . 7.7 tpp180 72.95 33.9 1.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.501 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HE ' HG22 ' A' ' 11' ' ' ILE . 5.6 ptm180 -50.72 -91.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.404 HG22 ' HE ' ' A' ' 10' ' ' ARG . 17.6 tt -84.22 -20.38 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.273 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.75 -42.2 58.84 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.706 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -46.23 -16.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.096 0.474 . . . . 0.0 110.436 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -100.77 -42.52 2.46 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.551 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.53 -41.02 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 116.996 0.398 . . . . 0.0 111.29 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.9 tttp -55.32 -51.14 67.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.868 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.9 tp -74.23 14.96 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.064 0.459 . . . . 0.0 110.442 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.435 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mm 57.14 101.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.402 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.82 92.62 0.82 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.197 -0.525 . . . . 0.0 112.005 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -58.15 -159.04 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.852 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.71 14.47 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.072 0.463 . . . . 0.0 110.293 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.443 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -171.98 -61.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.057 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 tt -83.81 44.73 1.01 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -164.78 14.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.472 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.56 137.23 53.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.635 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.0 mp . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.252 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.438 ' C ' ' H ' ' A' ' 4' ' ' LYS . 14.3 ptm180 -161.89 30.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.414 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -54.16 -9.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.486 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.438 ' H ' ' C ' ' A' ' 2' ' ' ARG . 32.3 ttmt -168.24 62.5 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.399 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.7 mmt-85 47.4 -174.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.603 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.436 ' O ' ' CZ ' ' A' ' 10' ' ' ARG . 78.7 mttt -82.69 76.17 9.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.406 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -168.64 0.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.524 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.536 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.46 -65.33 0.58 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.908 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.0 tpp85 -169.63 22.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.179 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' CZ ' ' O ' ' A' ' 6' ' ' LYS . 7.0 ptt180 -48.88 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 tp -78.16 -21.38 13.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.53 -35.79 68.09 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 5.5 ttpm? -49.47 -14.78 0.12 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.1 -45.0 1.53 Allowed Glycine 0 C--N 1.336 0.577 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.426 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -101.92 -39.36 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 116.844 0.322 . . . . 0.0 110.934 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 37.3 tptt -68.3 -34.04 75.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.807 0.337 . . . . 0.0 110.46 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.743 HG23 ' H ' ' A' ' 18' ' ' ILE . 9.1 tt -47.71 -64.93 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.455 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.743 ' H ' HG23 ' A' ' 17' ' ' ILE . 9.6 pt -157.34 37.79 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.83 22.15 1.2 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 121.22 -0.514 . . . . 0.0 111.997 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 18' ' ' ILE . . . 79.87 -15.63 14.61 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 111.94 -0.464 . . . . 0.0 111.94 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.74 -64.48 0.85 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.426 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.19 -35.97 69.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.484 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 21.5 tp -77.06 68.6 3.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.249 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.402 ' H ' ' H ' ' A' ' 25' ' ' HIS . 11.2 t70 -167.17 -12.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.419 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.444 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.5 OUTLIER -55.3 139.44 42.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.608 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.4 mm? . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.085 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.562 ' NH1' HH22 ' A' ' 5' ' ' ARG . 4.7 ptp180 -46.17 94.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.16 0.505 . . . . 0.0 110.783 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.41 ' N ' ' O ' ' A' ' 1' ' ' GLY . 94.8 mtt180 -66.29 -30.46 70.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.529 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -164.67 65.93 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.502 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.562 HH22 ' NH1' ' A' ' 2' ' ' ARG . 15.9 mmm180 49.9 17.82 0.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.6 mttm 55.94 78.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.404 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.471 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 30.0 t90 -168.18 5.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.759 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.46 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -55.0 -88.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.331 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 8.4 mmm180 -140.23 9.24 2.29 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.266 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -42.33 -86.22 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.691 0.281 . . . . 0.0 110.583 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -87.45 -17.26 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.64 -41.4 82.01 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.4 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -49.51 -16.1 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.092 0.472 . . . . 0.0 109.99 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.454 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.05 -39.0 3.91 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.513 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.6 m -113.79 -42.1 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 CA-C-N 116.94 0.37 . . . . 0.0 111.365 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . 56.2 tttp -51.04 -51.03 57.2 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.615 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.5 tt -77.8 38.33 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.325 0.584 . . . . 0.0 110.09 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.437 ' H ' ' C ' ' A' ' 16' ' ' LYS . 30.0 pt 35.17 51.32 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.725 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.511 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . 74.79 -75.88 1.23 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.878 -0.489 . . . . 0.0 111.878 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 46.61 -88.1 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -49.36 -29.22 5.89 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.92 -51.01 4.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.075 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -75.25 73.62 2.36 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.988 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -172.11 -22.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.223 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -65.07 -6.34 8.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.397 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.53 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.8 mp . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.143 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -166.03 130.0 2.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.932 0.396 . . . . 0.0 110.645 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -171.76 -30.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.274 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -164.66 60.06 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.233 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 49.4 mtp85 48.63 -172.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.68 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.478 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 22.7 mtmm -80.36 70.84 7.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.996 0.427 . . . . 0.0 110.56 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.478 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 95.6 m95 -158.81 -3.45 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.596 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 8' ' ' LEU . 0.9 OUTLIER -68.87 8.77 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.073 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.441 ' H ' ' C ' ' A' ' 7' ' ' TRP . 19.6 mmt180 64.2 44.2 4.56 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.054 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.1 ptp180 -51.95 -93.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.3 pt -84.88 -6.08 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.554 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -61.32 -46.43 94.44 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.763 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -45.09 -17.18 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.123 0.487 . . . . 0.0 110.373 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -97.12 -44.23 2.85 Favored Glycine 0 C--N 1.336 0.532 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.771 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.8 m -107.24 -42.41 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 120.615 0.245 . . . . 0.0 110.649 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.554 ' N ' ' O ' ' A' ' 12' ' ' GLY . 34.5 tptt -66.18 -41.37 90.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.001 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.7 tt -40.2 -23.73 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.886 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.545 HG23 ' N ' ' A' ' 19' ' ' GLY . 10.3 tp -158.7 -46.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.718 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.545 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 70.86 60.2 4.7 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.93 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 172.15 -71.14 0.11 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.823 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.41 -55.42 31.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.261 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.99 -17.37 62.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.296 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 tt -79.47 55.23 1.89 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.288 0.566 . . . . 0.0 109.614 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -162.24 -47.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.825 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 54.53 82.92 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.641 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.33 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.092 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -172.41 160.47 4.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.819 0.342 . . . . 0.0 110.618 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.433 ' C ' ' H ' ' A' ' 5' ' ' ARG . 66.4 mtm180 -145.13 -78.66 0.19 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.243 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -75.59 14.79 0.57 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.442 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 3' ' ' ARG . 3.9 tpt180 54.1 68.52 0.84 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.571 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.6 mttt 51.61 89.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.529 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 32.3 t-105 -168.86 -14.83 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.58 HD12 ' N ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -77.81 -16.35 58.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.812 179.193 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.58 ' N ' HD12 ' A' ' 8' ' ' LEU . 30.5 mmt180 53.57 64.67 1.76 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.661 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 11.8 ptm180 -95.3 -47.27 6.39 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.033 0.444 . . . . 0.0 110.68 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.481 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 9.4 tp -129.95 -21.97 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.11 -36.17 73.31 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.748 178.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -52.91 -18.91 2.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.828 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -94.26 -36.57 5.65 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.24 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.45 HG23 ' N ' ' A' ' 16' ' ' LYS . 21.4 m -118.97 -45.77 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.9 tttm -49.35 -47.53 47.31 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.164 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.565 HG23 ' N ' ' A' ' 18' ' ' ILE . 10.1 tp -70.7 -48.27 59.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.313 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.565 ' N ' HG23 ' A' ' 17' ' ' ILE . 37.2 mt -136.02 89.71 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.443 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 155.22 -18.0 0.53 Allowed Glycine 0 C--N 1.331 0.262 0 N-CA-C 111.554 -0.618 . . . . 0.0 111.554 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.92 -9.82 0.35 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.057 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . 56.82 19.32 4.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.908 0.385 . . . . 0.0 110.452 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.69 -33.3 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.133 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.15 26.46 0.63 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.239 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -164.43 -43.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.51 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 54.29 87.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.53 ' N ' HD12 ' A' ' 26' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.072 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -77.44 44.91 0.45 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.742 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -54.14 -27.93 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.658 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -149.84 51.47 0.92 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' TRP . 24.6 ttt-85 61.07 137.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.328 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -48.72 88.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.627 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.496 ' N ' ' O ' ' A' ' 5' ' ' ARG . 47.6 t90 -167.19 -9.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 -179.735 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.533 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.7 -74.74 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 121.034 -0.267 . . . . 0.0 110.444 -179.807 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 mmm-85 176.04 20.72 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.36 -88.5 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.15 179.747 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -84.13 -17.87 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.543 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.31 -43.33 64.85 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -45.7 -18.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.016 0.436 . . . . 0.0 110.391 179.209 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.9 -42.26 3.61 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.071 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -107.87 -44.38 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 116.653 0.227 . . . . 0.0 110.855 -179.742 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' A' ' 12' ' ' GLY . 60.1 tttm -58.86 -27.0 64.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.725 179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.425 HG23 ' O ' ' A' ' 17' ' ' ILE . 3.2 tp -70.49 25.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.951 0.405 . . . . 0.0 110.779 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.533 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.6 mt 61.85 94.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 110.348 179.922 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.52 1.76 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.742 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.85 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.201 -0.523 . . . . 0.0 111.964 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.42 -42.31 62.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.869 0.366 . . . . 0.0 110.484 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.48 -17.21 60.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.504 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.508 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -68.27 1.51 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.108 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.404 ' O ' ' O ' ' A' ' 25' ' ' HIS . 36.5 t70 -164.83 -56.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.686 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.47 ' ND1' ' N ' ' A' ' 26' ' ' LEU . 66.7 t-80 57.88 157.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.47 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 14.9 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.472 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -78.51 43.72 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 110.659 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -68.3 -36.69 79.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.565 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.75 71.25 0.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.156 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.501 ' O ' ' N ' ' A' ' 7' ' ' TRP . 7.3 tpm_? 61.66 131.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.309 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -54.75 82.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.065 -179.562 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.511 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 70.2 t90 -173.26 13.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.628 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.742 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -70.8 -37.6 73.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.924 -179.156 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.88 22.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.23 -179.666 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -51.78 -88.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.7 tp -82.98 -21.11 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.051 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.47 -37.14 59.68 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.445 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -46.53 -18.27 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 0.0 110.409 179.001 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.27 -44.14 1.91 Allowed Glycine 0 C--N 1.334 0.464 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.503 -179.659 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.6 m -103.43 -39.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 116.889 0.345 . . . . 0.0 111.161 -179.532 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 61.1 tttp -68.57 -32.44 72.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.1 tt -44.96 -26.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.924 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.3 mt -135.27 -78.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.45 -2.79 0.06 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 121.262 -0.494 . . . . 0.0 111.969 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 76.21 -5.43 42.63 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 121.203 -0.522 . . . . 0.0 111.978 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.43 19.28 0.26 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.802 0.334 . . . . 0.0 110.527 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -160.87 -46.89 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tp -78.23 58.71 2.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.362 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -170.16 -16.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.6 t-80 -77.74 62.3 2.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.687 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.545 179.883 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 3' ' ' ARG . 46.5 ttt85 -170.66 -18.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.773 0.321 . . . . 0.0 110.483 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 2' ' ' ARG . 82.7 mtm180 -53.19 -23.99 9.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.732 -179.919 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.5 mttp -146.04 47.24 1.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.399 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.8 mtm180 51.34 -99.66 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.375 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.7 mtmm -138.54 77.19 1.61 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.952 179.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 88.0 t90 -163.96 5.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.95 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.444 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -85.61 6.05 29.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.861 179.892 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 54.13 55.48 8.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.893 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 5.0 ptm180 -54.2 -50.16 67.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.109 0.48 . . . . 0.0 109.944 179.66 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.465 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 15.7 tt -126.66 -18.45 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.836 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.442 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -56.34 -31.07 59.28 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 178.782 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttpp -53.59 -11.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.163 0.506 . . . . 0.0 109.813 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -108.43 -46.29 1.0 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.487 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.9 m -97.47 -39.35 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 117.005 0.402 . . . . 0.0 111.607 -179.329 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -73.93 -33.82 64.1 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.588 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.471 HG23 ' N ' ' A' ' 18' ' ' ILE . 17.3 tt -45.97 -40.22 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.442 -179.586 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.506 ' O ' HG23 ' A' ' 18' ' ' ILE . 12.1 tt -160.82 33.52 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.395 0.617 . . . . 0.0 110.672 -179.717 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -149.25 18.85 1.19 Allowed Glycine 0 C--N 1.331 0.277 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -163.64 -50.39 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.89 -80.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.782 0.325 . . . . 0.0 110.26 179.741 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.55 -27.0 67.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.15 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.61 64.14 2.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.306 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.427 ' C ' ' H ' ' A' ' 26' ' ' LEU . 17.6 t70 -170.76 -25.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.603 -179.985 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.456 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 1.1 m-70 -76.82 33.64 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.728 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' H ' ' C ' ' A' ' 24' ' ' ASP . 13.2 mt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.512 179.868 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 111.96 -0.456 . . . . 0.0 111.96 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.465 ' NH1' ' O ' ' A' ' 2' ' ' ARG . 2.9 ptm180 -53.39 85.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.981 0.419 . . . . 0.0 110.432 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 1' ' ' GLY . 44.7 mtp85 -53.63 -48.96 68.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -161.59 63.75 0.26 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.897 0.38 . . . . 0.0 110.484 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER 53.44 -103.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.061 179.809 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -96.35 178.37 5.39 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.645 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 47.0 m95 58.28 20.31 7.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.982 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.575 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.87 -61.76 1.95 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.041 0.448 . . . . 0.0 109.864 179.824 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -167.18 15.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.444 179.844 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -48.12 -87.36 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.02 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.2 pt -84.49 -18.08 9.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.842 0.353 . . . . 0.0 110.085 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.32 -38.46 68.79 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -49.58 -15.72 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.165 0.507 . . . . 0.0 109.892 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.441 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.62 -45.8 1.9 Allowed Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.329 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -101.19 -41.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 117.032 0.416 . . . . 0.0 111.063 -179.677 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' GLY . 9.1 tmtm? -59.19 -36.99 76.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.781 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.9 tt -63.82 -0.38 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.097 179.665 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.459 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.9 mt 63.15 94.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.241 -179.847 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -175.39 1.14 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.755 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -67.93 162.77 48.26 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.236 -0.507 . . . . 0.0 111.906 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.93 -54.68 18.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.847 0.356 . . . . 0.0 110.493 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.435 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -76.94 -33.43 57.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.419 179.809 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.514 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.2 mm? -77.85 36.0 0.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.899 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 22' ' ' ALA . 22.3 t0 -167.37 -71.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.4 ' O ' ' O ' ' A' ' 24' ' ' ASP . 45.0 t60 53.49 103.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.511 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.5 mp . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.11 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.401 ' O ' ' O ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 1' ' ' GLY . 84.2 mtt180 60.4 134.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.976 0.417 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -171.38 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.19 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -93.38 26.45 2.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.215 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 9.8 mpt_? 53.7 58.02 5.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.159 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.9 mttt 51.65 79.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.412 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.474 ' CD2' ' O ' ' A' ' 7' ' ' TRP . 83.5 t90 -160.33 6.3 0.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.139 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.419 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -83.77 24.41 0.89 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.686 179.816 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 58.69 39.3 24.58 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.847 179.593 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -52.58 -92.9 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.772 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.6 tt -80.85 -15.25 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.502 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.455 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -57.03 -39.53 89.79 Favored Glycine 0 C--N 1.335 0.503 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.495 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -51.5 -12.73 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.463 . . . . 0.0 109.821 178.846 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -106.28 -41.52 1.76 Allowed Glycine 0 C--N 1.338 0.64 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.783 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.52 -38.24 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 117.314 0.557 . . . . 0.0 111.01 -179.299 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 12' ' ' GLY . 6.1 tmtt? -59.29 -61.26 2.76 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.582 ' O ' HG22 ' A' ' 18' ' ' ILE . 17.2 tt -51.82 -34.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.385 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.657 ' O ' HG23 ' A' ' 18' ' ' ILE . 17.2 tt 126.23 107.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 124.888 1.368 . . . . 0.0 110.077 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.86 70.56 1.81 Allowed Glycine 0 C--N 1.334 0.436 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 179.8 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.3 -39.37 9.68 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 121.332 -0.461 . . . . 0.0 112.342 -179.874 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.0 -55.57 11.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.817 0.341 . . . . 0.0 110.56 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.91 -50.27 50.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.309 179.83 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.59 67.83 2.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.424 179.879 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -171.58 -23.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.452 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -73.45 -37.17 65.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.453 179.905 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.6 ptp85 -172.26 49.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.799 0.333 . . . . 0.0 110.484 -179.938 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -71.67 -31.31 66.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -143.32 25.65 1.69 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.275 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 74.08 -65.19 0.36 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.23 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -146.78 166.69 25.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.357 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 23.7 m95 63.35 15.69 8.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.316 179.589 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.571 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.47 -70.45 0.09 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.854 0.359 . . . . 0.0 110.332 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.47 15.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.08 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -42.63 -89.14 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.194 179.586 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -77.12 -20.29 14.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.427 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.6 -42.08 90.13 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -48.02 -15.46 0.07 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.968 0.414 . . . . 0.0 110.071 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.82 -41.71 2.83 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.403 -179.969 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.9 m -105.96 -42.96 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 116.961 0.381 . . . . 0.0 110.679 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.1 tttp -56.41 -38.67 71.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.833 0.349 . . . . 0.0 110.381 179.72 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 tt -64.27 0.35 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.7 mt 61.67 66.46 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.166 -179.796 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.25 -176.75 14.52 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.149 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.96 86.99 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.26 -0.495 . . . . 0.0 111.979 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -54.14 49.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.49 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.77 -21.37 66.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.426 179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 tp -67.61 -5.06 13.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.248 -179.927 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.495 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 34.2 t70 -160.73 13.32 0.11 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.686 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.495 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 34.5 p-80 40.9 27.04 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.2 179.995 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.9 tp . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.357 179.999 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.018 -0.433 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.7 ttm-85 60.39 47.8 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.165 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -77.86 -27.48 49.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.417 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -164.8 63.85 0.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.366 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 52.42 -106.06 0.26 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.323 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 96.1 mttt -141.63 70.66 1.34 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.817 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.496 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.0 m-90 -160.05 3.51 0.08 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.315 -179.712 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.567 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -64.38 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.82 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.26 19.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.828 179.419 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -39.21 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.7 tt -83.3 -17.18 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.95 -42.8 81.59 Favored Glycine 0 N--CA 1.451 -0.364 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 179.558 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -47.93 -15.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.961 0.41 . . . . 0.0 110.234 179.206 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.62 -40.44 2.36 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.543 -179.847 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -107.24 -40.6 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 116.935 0.367 . . . . 0.0 110.981 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 12' ' ' GLY . 34.9 ttpt -56.67 -60.48 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.481 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -73.94 10.91 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 109.986 179.94 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.432 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.0 mt 57.4 87.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.437 179.994 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.33 93.22 1.1 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.328 -0.463 . . . . 0.0 111.998 179.922 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.421 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -60.61 -10.66 18.83 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.153 -0.546 . . . . 0.0 111.854 179.966 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.23 10.71 0.9 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.781 0.324 . . . . 0.0 110.46 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -163.79 -47.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.453 -179.926 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 tt -76.64 39.62 0.22 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.914 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 22' ' ' ALA . 18.7 t70 -170.22 1.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -54.67 -14.45 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.454 179.996 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 pp . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 -179.899 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 111.916 -0.474 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -79.11 25.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.744 0.306 . . . . 0.0 110.477 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.405 ' H ' ' C ' ' A' ' 1' ' ' GLY . 36.6 ttm180 -60.25 -26.44 66.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.595 179.964 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' O ' ' O ' ' A' ' 5' ' ' ARG . 56.0 tttm -161.55 44.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.863 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' TRP . 15.2 tpp180 60.6 137.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.22 -179.596 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.84 88.0 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.082 0.468 . . . . 0.0 110.26 -179.89 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.513 ' N ' ' O ' ' A' ' 5' ' ' ARG . 64.6 t-105 -170.96 -20.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.403 -179.788 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 77.65 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.889 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 7' ' ' TRP . 23.8 mmt180 45.71 25.67 0.29 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.443 179.068 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -45.93 -88.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.501 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.3 pt -86.71 -14.56 10.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 178.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.38 -37.87 83.85 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -52.57 -13.69 0.41 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.906 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.443 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.83 -44.8 2.38 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.162 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.7 m -106.64 -42.83 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 116.914 0.357 . . . . 0.0 111.239 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.0 tptm -53.99 -42.07 68.62 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.433 -179.589 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.552 HG23 ' H ' ' A' ' 18' ' ' ILE . 2.2 tp -50.43 -56.02 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.488 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.636 ' O ' HG23 ' A' ' 18' ' ' ILE . 13.4 tt -174.02 107.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.208 0.528 . . . . 0.0 110.431 178.723 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.6 77.28 2.12 Favored Glycine 0 C--N 1.331 0.296 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.98 -39.39 6.4 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.353 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.92 -49.96 58.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.686 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.4 -47.7 19.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.9 tt -77.6 60.6 2.18 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -171.87 9.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.46 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 14.3 p-80 -48.34 151.58 1.03 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.746 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.41 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.319 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.435 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.232 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -61.46 81.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.792 0.33 . . . . 0.0 110.482 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.435 ' N ' ' O ' ' A' ' 1' ' ' GLY . 60.4 ttm-85 -75.2 -27.94 59.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.666 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -145.8 50.37 1.19 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.478 -179.923 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 50.69 -94.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.0 mttp -144.33 88.12 1.92 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.475 -179.839 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.41 ' H ' ' H ' ' A' ' 8' ' ' LEU . 42.7 t90 -171.37 -6.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.992 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.577 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.9 -74.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.218 -179.714 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.97 19.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.557 -179.977 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.76 -89.37 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.141 179.696 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.4 pt -84.48 -13.23 11.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.229 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.509 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.67 -45.18 85.88 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.95 -15.33 0.19 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.793 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . -101.53 -43.66 2.11 Favored Glycine 0 C--N 1.336 0.549 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.361 179.998 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.54 -40.83 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.09 0.445 . . . . 0.0 110.978 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 12' ' ' GLY . 10.9 ttmm -51.85 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.354 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 pt -73.56 12.45 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.594 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.42 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.7 mt 59.98 100.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.378 179.994 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -74.1 91.48 0.72 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.869 179.911 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -45.06 -19.11 0.17 Allowed Glycine 0 C--N 1.33 0.224 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.294 -179.918 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 19' ' ' GLY . . . -53.48 -74.01 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.799 0.333 . . . . 0.0 110.394 179.99 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -81.45 -37.69 27.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.564 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.0 mm? -73.89 69.62 1.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.14 -179.962 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -171.08 -34.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.504 179.905 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -65.7 -71.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.525 179.942 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.523 HD22 ' N ' ' A' ' 26' ' ' LEU . 2.5 mm? . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.008 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -60.44 125.45 23.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.789 0.328 . . . . 0.0 110.533 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -73.76 -52.5 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.677 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -140.66 25.23 2.19 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.122 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' TRP . 83.8 mtm180 54.01 -175.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 -179.611 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -65.79 76.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.414 179.933 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.406 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 56.5 t-105 -170.69 -5.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.729 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.537 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -45.69 -73.07 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.418 -179.865 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.74 18.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.195 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -41.93 -89.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.264 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.3 pt -87.87 -11.5 10.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.05 -45.73 80.56 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.811 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -45.42 -17.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 178.836 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.75 -41.66 3.54 Favored Glycine 0 C--N 1.335 0.514 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.249 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -108.33 -44.08 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 116.777 0.289 . . . . 0.0 111.023 -179.654 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 12' ' ' GLY . 16.6 ttpp -53.36 -37.68 62.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.77 0.319 . . . . 0.0 110.634 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.5 tt -71.37 14.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.664 -179.73 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.467 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.5 mt 60.23 108.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.85 0.357 . . . . 0.0 110.485 179.977 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.09 1.53 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.408 ' H ' ' H ' ' A' ' 21' ' ' ALA . . . -175.4 2.96 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.942 -179.938 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.408 ' H ' ' H ' ' A' ' 20' ' ' GLY . . . -72.12 -78.73 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.24 -26.33 63.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.456 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.509 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.5 mm? -79.9 36.76 0.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.129 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -168.88 -23.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.699 -179.989 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 59.6 t60 54.19 63.57 2.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.405 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.413 -179.956 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -76.74 63.37 2.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.74 0.305 . . . . 0.0 110.492 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -75.49 -34.96 60.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.548 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 6' ' ' LYS . 75.4 mttt -145.65 30.07 1.11 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.361 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.2 mmt85 57.45 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.683 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 4' ' ' LYS . 81.9 mttt -145.69 75.98 1.45 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.871 0.367 . . . . 0.0 110.179 179.888 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 70.9 t-105 -166.09 7.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.58 -179.805 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.565 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.52 -89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.825 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -169.51 27.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.544 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -50.65 -89.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.315 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 pt -84.03 -16.35 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.042 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.56 -41.43 64.57 Favored Glycine 0 N--CA 1.45 -0.372 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.622 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' CB ' ' NZ ' ' A' ' 13' ' ' LYS . 5.4 ttpm? -44.13 -19.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.01 0.433 . . . . 0.0 110.207 178.81 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -100.88 -44.23 2.11 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.493 -179.734 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.3 m -104.25 -40.53 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 116.974 0.387 . . . . 0.0 111.282 -179.4 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.8 tttt -69.52 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.883 -179.724 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.8 tt -48.1 -26.14 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.541 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.3 mt -135.25 -78.17 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.468 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 155.94 32.02 0.03 OUTLIER Glycine 0 C--N 1.333 0.38 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 64.49 2.38 7.35 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.737 -179.772 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.65 25.77 0.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 -179.935 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.41 -43.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.467 -179.961 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.4 tp -78.08 45.75 0.55 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.276 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -169.63 -40.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.557 -179.957 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 60.1 133.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.8 mp . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.11 179.974 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.382 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' LYS . 42.1 mtp85 -69.85 -69.42 0.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.58 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 60.63 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.81 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' ARG . 78.2 tttt -154.11 51.14 0.66 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.972 0.415 . . . . 0.0 110.161 179.971 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 47.36 40.43 10.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.581 -179.854 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 54.7 84.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.484 -179.997 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.469 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 77.0 t-105 -171.24 8.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.521 -179.99 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.568 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.23 -70.49 0.09 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.228 -179.907 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.75 14.82 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.767 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -45.88 -87.77 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.242 179.719 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.0 mm -84.88 -18.96 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.736 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.25 -40.12 83.62 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.565 -0.826 . . . . 0.0 111.064 179.558 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -49.44 -16.22 0.19 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.189 0.518 . . . . 0.0 109.864 178.813 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.35 -45.98 1.91 Allowed Glycine 0 C--N 1.333 0.407 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.182 179.844 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -102.2 -41.05 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 116.873 0.336 . . . . 0.0 111.301 -179.559 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.8 tttp -57.38 -41.72 80.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.729 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.8 tt -68.3 4.62 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 121.01 0.433 . . . . 0.0 110.163 179.908 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.442 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.9 mt 61.3 101.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.36 -179.767 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.28 -75.78 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.833 179.986 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.9 -29.18 72.55 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.14 -0.553 . . . . 0.0 111.814 179.837 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.67 -61.6 2.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.869 0.366 . . . . 0.0 110.296 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.17 72.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.251 179.756 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.12 41.86 0.46 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.915 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.485 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 8.9 t70 -167.3 -19.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.42 -179.923 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.485 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 34.9 p-80 40.71 93.01 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.252 179.922 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.473 179.855 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -168.13 22.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.824 0.345 . . . . 0.0 110.507 -179.985 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -51.7 -22.55 3.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.488 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -159.51 63.9 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.248 -179.975 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 52.49 -171.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.328 -179.864 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.539 ' CD ' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -75.6 95.03 3.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.784 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.428 ' C ' ' H ' ' A' ' 9' ' ' ARG . 59.8 t-105 -161.91 -14.13 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.541 -179.99 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.636 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -67.62 4.1 1.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.146 -179.864 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 7' ' ' TRP . 31.0 mmt180 59.58 32.95 21.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.08 -179.873 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HE ' HG12 ' A' ' 11' ' ' ILE . 1.8 ptm180 -48.36 -91.55 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.318 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.425 HG12 ' HE ' ' A' ' 10' ' ' ARG . 9.5 pt -95.66 -7.2 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.747 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.2 -35.55 88.22 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 179.644 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -53.44 -14.59 0.82 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.07 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.419 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.63 -43.23 2.53 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.303 -179.816 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' N ' ' A' ' 16' ' ' LYS . 21.6 m -108.74 -41.13 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 116.86 0.33 . . . . 0.0 111.29 -179.475 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.8 ttpt -62.32 -31.71 72.36 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.372 -179.722 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.1 tt -62.76 -1.59 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.057 0.456 . . . . 0.0 110.084 179.497 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.6 mt 64.26 69.52 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.341 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.63 -16.07 80.62 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.905 179.878 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 75.57 -11.61 9.51 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.277 -0.487 . . . . 0.0 111.992 -179.975 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.24 17.73 0.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 179.873 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.15 -49.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.28 -179.994 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.8 mt -79.51 66.65 5.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.41 179.854 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -170.46 -26.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -61.87 -77.39 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.729 -179.943 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.133 -179.883 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 mtt-85 -67.63 85.53 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.781 0.324 . . . . 0.0 110.562 -179.947 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 50.23 -113.44 0.66 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 179.963 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 6' ' ' LYS . 46.1 mttm -80.65 36.59 0.39 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.727 0.299 . . . . 0.0 110.508 179.947 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 54.05 -84.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.476 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 4' ' ' LYS . 85.2 mttt -143.13 82.41 1.75 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.262 179.967 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 62.1 t-105 -162.65 -0.67 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.506 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -62.51 -90.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.62 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.29 23.18 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.502 179.607 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -45.46 -90.29 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.022 179.522 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 tp -76.06 -19.02 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.18 -42.25 95.18 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.232 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -46.33 -17.98 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.077 0.465 . . . . 0.0 110.243 179.005 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.467 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.13 -40.76 3.66 Favored Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.198 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -109.56 -44.21 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 116.771 0.285 . . . . 0.0 111.196 -179.62 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.6 ttmt -51.5 -41.74 61.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.719 -179.75 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.0 pt -39.81 -39.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.14 -179.86 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.568 HG23 ' N ' ' A' ' 19' ' ' GLY . 16.8 tt -171.82 -47.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.781 179.656 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.568 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 154.96 37.85 0.02 OUTLIER Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.899 -0.48 . . . . 0.0 111.899 179.976 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.17 -139.72 21.45 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.402 -0.428 . . . . 0.0 112.112 179.939 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.74 94.34 9.09 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.57 0.224 . . . . 0.0 111.152 -179.277 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.422 ' C ' ' N ' ' A' ' 24' ' ' ASP . . . 57.87 62.22 2.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -178.83 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.507 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.9 mp 56.32 15.65 2.04 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 -177.16 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.422 ' N ' ' C ' ' A' ' 22' ' ' ALA . 20.3 t70 49.57 43.21 23.9 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 122.264 1.03 . . . . 0.0 108.949 -179.111 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -79.34 112.31 16.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.561 -1.654 . . . . 0.0 110.385 -179.651 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.519 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.9 mp . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.119 179.897 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 N-CA-C 111.985 -0.446 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -70.29 2.05 4.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.804 0.335 . . . . 0.0 110.633 180.0 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -49.69 -28.58 6.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -148.39 154.78 40.38 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.22 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.9 mtp85 -60.27 -76.12 0.05 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.522 179.958 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 48.8 mtmt -136.24 61.34 1.65 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.093 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 97.5 m95 -159.34 4.76 0.09 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.331 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.482 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -51.93 -90.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.439 -179.701 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 2.5 mmt-85 -147.41 16.52 1.16 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.301 -179.688 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.448 ' CZ ' ' O ' ' A' ' 6' ' ' LYS . 5.8 ptt180 -49.27 -86.63 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.764 179.849 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 tt -95.55 -14.5 7.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.233 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.506 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.93 -38.34 74.31 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.652 179.673 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -51.5 -18.7 1.16 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.25 0.548 . . . . 0.0 109.587 179.034 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.417 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.7 -43.4 3.38 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.532 -179.77 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -107.54 -42.53 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.997 0.399 . . . . 0.0 111.299 -179.469 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' N ' ' O ' ' A' ' 12' ' ' GLY . 1.6 ttpm? -58.01 -34.37 69.94 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.4 -179.953 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.2 tt -64.34 0.29 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 121.118 0.485 . . . . 0.0 109.93 179.519 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.464 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 63.19 96.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.503 -179.991 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.93 6.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.288 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . 179.67 -139.69 3.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.148 -0.549 . . . . 0.0 111.748 -179.966 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.33 -90.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.743 0.306 . . . . 0.0 110.537 179.935 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -69.56 -41.4 75.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.481 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tp -78.91 66.38 4.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.325 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.427 ' C ' ' H ' ' A' ' 26' ' ' LEU . 12.7 t70 -167.31 -4.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.444 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.404 ' H ' ' H ' ' A' ' 24' ' ' ASP . 9.2 p-80 -71.67 9.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.689 -179.851 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.54 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.128 179.852 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.258 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -166.76 51.57 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -60.07 -55.97 27.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.478 179.945 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -82.89 37.05 0.52 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.594 179.963 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 41.2 mtt-85 52.42 -92.6 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.641 179.886 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -146.97 46.67 1.17 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.191 -179.949 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -122.48 -3.44 8.86 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.602 179.707 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 14.58 0.92 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.181 179.626 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 62.83 42.94 7.39 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.352 179.326 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -52.51 -91.91 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.79 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.3 pp -89.35 -4.58 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.755 178.823 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.552 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -65.67 -38.39 94.51 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 179.618 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -51.4 -16.79 0.62 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.037 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.81 -39.78 4.28 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.378 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.9 m -114.19 -41.72 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 120.795 0.331 . . . . 0.0 111.207 -179.461 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' A' ' 12' ' ' GLY . 79.4 tttt -66.42 -26.47 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.139 -179.722 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 tp -40.95 -42.14 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.278 -179.537 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 tt -170.87 6.63 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.915 0.388 . . . . 0.0 110.613 179.725 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.76 -22.9 1.26 Allowed Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.239 -179.998 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.62 -51.3 3.36 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.307 -0.473 . . . . 0.0 111.946 -179.912 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.3 -56.67 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.852 0.358 . . . . 0.0 110.429 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' C ' ' N ' ' A' ' 24' ' ' ASP . . . -66.01 -23.48 66.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.298 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.9 tp -54.26 -11.35 0.48 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.324 179.939 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 22' ' ' ALA . 29.8 t70 -155.17 8.87 0.29 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.599 -179.95 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.432 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 4.8 m80 52.96 103.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.69 179.826 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.958 179.88 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.911 -0.476 . . . . 0.0 111.911 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 ttp85 -169.67 -1.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.933 0.397 . . . . 0.0 110.365 179.986 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -48.02 -24.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.504 179.794 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -143.34 159.05 43.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.755 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 11.3 tpp85 -73.66 72.27 1.45 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mttm 57.03 60.55 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' CD1' ' O ' ' A' ' 5' ' ' ARG . 85.9 m95 -150.5 12.22 0.71 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.504 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.43 59.54 5.24 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.095 179.979 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 52.96 37.02 23.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.788 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -52.41 -85.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.072 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.4 tt -90.6 -13.46 9.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.162 179.167 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.536 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.71 -42.69 85.77 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.141 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.37 -17.97 0.33 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.786 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.452 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -92.32 -44.03 4.16 Favored Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.716 179.779 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.44 HG23 ' N ' ' A' ' 16' ' ' LYS . 17.5 m -110.15 -46.45 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.67 0.235 . . . . 0.0 110.997 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.553 ' C ' ' H ' ' A' ' 18' ' ' ILE . 33.7 ttmt -52.34 -29.19 22.43 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.427 HG23 ' O ' ' A' ' 17' ' ' ILE . 3.0 tp -69.85 27.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.808 0.337 . . . . 0.0 110.519 179.232 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.553 ' H ' ' C ' ' A' ' 16' ' ' LYS . 35.4 pt 37.69 48.82 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.33 -179.778 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -79.02 38.36 1.98 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.929 179.769 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.67 -21.81 1.92 Allowed Glycine 0 C--N 1.33 0.223 0 C-N-CA 121.144 -0.55 . . . . 0.0 111.863 -179.93 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -65.91 -50.97 62.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.768 0.318 . . . . 0.0 110.381 179.978 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -36.93 60.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.49 -179.96 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 tp -76.89 41.51 0.28 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.392 -179.908 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -170.89 -23.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.567 -179.948 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 51.3 73.02 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.55 179.972 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.426 ' C ' HD23 ' A' ' 26' ' ' LEU . 1.6 tt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.136 179.99 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 N-CA-C 111.943 -0.463 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -170.25 113.65 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.873 0.368 . . . . 0.0 110.247 179.937 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 65.5 mtt85 52.08 -105.87 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.384 -179.916 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' O ' ' N ' ' A' ' 6' ' ' LYS . 79.1 mttt -80.73 38.71 0.45 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.763 0.316 . . . . 0.0 110.543 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.488 HH21 ' NZ ' ' A' ' 6' ' ' LYS . 84.4 mtm180 57.29 -78.63 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.011 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -157.18 74.54 0.78 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.893 0.378 . . . . 0.0 110.209 -179.845 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.429 ' CD2' ' O ' ' A' ' 7' ' ' TRP . 61.4 t90 -167.49 14.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.522 179.836 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.487 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -64.8 -94.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.165 179.844 . . . . . . . . 3 3 . 1 . 038 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.487 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 63.2 mmt-85 -135.12 11.95 3.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.402 -179.772 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -42.25 -87.53 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.633 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.9 tp -80.32 -17.88 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.968 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.8 -37.42 84.09 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.313 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -52.6 -13.53 0.4 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.176 0.512 . . . . 0.0 109.683 179.209 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.04 -41.22 2.89 Favored Glycine 0 C--N 1.334 0.461 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.125 179.927 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.31 -43.57 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-N 116.61 0.205 . . . . 0.0 111.404 -179.423 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . 45.3 mtpt -65.95 -25.18 67.0 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.505 -179.882 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.682 HG23 ' H ' ' A' ' 18' ' ' ILE . 13.6 tt -47.38 -60.47 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.932 -179.76 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.682 ' H ' HG23 ' A' ' 17' ' ' ILE . 10.6 tt -171.71 24.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.392 0.615 . . . . 0.0 109.703 179.928 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.437 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -40.29 94.77 0.01 OUTLIER Glycine 0 C--N 1.332 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.475 -179.943 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . -43.12 -21.11 0.11 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 121.354 -0.45 . . . . 0.0 112.21 179.998 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.437 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -69.98 -52.83 21.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.86 0.362 . . . . 0.0 110.25 179.819 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.36 64.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.385 179.806 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.4 tp -50.0 -23.34 1.98 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.433 179.919 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -163.64 64.98 0.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.501 179.831 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 29.5 p80 -69.18 159.85 32.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.614 -179.912 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.57 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.112 179.973 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.224 0 N-CA-C 111.916 -0.473 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.424 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 55.3 ttt180 64.68 -1.92 0.73 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.812 0.339 . . . . 0.0 110.514 -179.99 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 1' ' ' GLY . 9.1 tpm_? -51.32 -22.55 2.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.117 0.484 . . . . 0.0 109.778 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -144.46 175.88 9.79 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.793 179.468 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -70.96 -71.41 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.806 -179.693 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -144.89 73.82 1.38 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.326 -179.778 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -170.88 6.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.233 -179.97 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.601 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.87 -75.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.185 -179.814 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' N ' ' CD ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.55 14.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.292 179.382 . . . . . . . . 3 3 . 1 . 039 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -41.91 -87.09 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.48 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.8 tt -79.12 -10.7 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.934 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.51 -44.2 97.98 Favored Glycine 0 C--N 1.336 0.582 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.556 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -46.92 -17.91 0.06 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.092 0.472 . . . . 0.0 109.846 178.54 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.47 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.34 -44.47 2.55 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.498 -179.993 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.88 -42.01 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 117.005 0.403 . . . . 0.0 110.879 -179.566 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 17.4 ttmm -61.94 -32.75 73.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.759 0.314 . . . . 0.0 110.443 -179.97 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.526 HG23 ' N ' ' A' ' 18' ' ' ILE . 8.8 tt -60.21 -45.8 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.526 ' N ' HG23 ' A' ' 17' ' ' ILE . 76.2 mt -138.87 -65.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.414 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.12 7.61 Favored Glycine 0 C--N 1.33 0.236 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.033 -179.967 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . 164.99 168.62 27.43 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 121.343 -0.456 . . . . 0.0 111.984 179.987 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.7 -88.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.707 0.289 . . . . 0.0 110.522 -179.959 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -57.2 -21.75 35.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.306 179.928 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.85 -17.91 7.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.051 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' C ' ' H ' ' A' ' 26' ' ' LEU . 47.8 t0 -154.28 61.75 0.7 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.514 -179.985 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -77.13 34.25 0.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.555 179.826 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 24' ' ' ASP . 12.1 mt . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.545 -179.815 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.45 -35.81 70.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.789 0.328 . . . . 0.0 110.542 179.912 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 47.48 -97.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.734 -179.992 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' O ' ' O ' ' A' ' 5' ' ' ARG . 62.5 mttt -97.98 36.58 1.53 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.277 179.97 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 7' ' ' TRP . 77.1 mtp180 56.15 162.05 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.187 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' O ' ' CD2' ' A' ' 7' ' ' TRP . 1.4 mptm? -49.0 87.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.745 0.307 . . . . 0.0 110.656 -179.408 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.527 ' N ' ' O ' ' A' ' 5' ' ' ARG . 0.4 OUTLIER -172.34 -18.43 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.105 179.839 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.568 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -49.77 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.241 179.875 . . . . . . . . 3 3 . 1 . 040 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -172.5 21.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.106 -179.861 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.6 ptt85 -43.81 -90.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.495 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.5 tt -83.65 -14.45 11.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.2 -42.25 81.42 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.536 -0.625 . . . . 0.0 111.536 179.672 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -47.39 -16.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 110.137 179.064 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.9 -42.54 2.43 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.644 -179.844 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -104.91 -41.16 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 117.093 0.446 . . . . 0.0 111.077 -179.456 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 62.1 tttm -54.41 -53.0 59.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 110.716 -179.721 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -73.81 13.02 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 120.998 0.427 . . . . 0.0 110.211 -179.852 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.424 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.3 mt 59.21 104.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.372 -179.907 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.37 139.83 26.36 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.191 -179.813 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.432 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 50.4 15.48 1.19 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.126 179.796 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 49.92 16.2 0.21 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.34 -179.786 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.432 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -158.39 -29.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.898 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.9 tp -80.16 53.91 1.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.968 179.622 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -163.72 -32.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.274 -179.62 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -78.92 102.91 8.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.549 179.984 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.1 mp . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.14 179.932 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 111.981 -0.448 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -169.48 89.22 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.751 0.31 . . . . 0.0 110.542 -179.988 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -97.06 -27.69 14.48 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.72 -179.94 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.517 ' O ' ' N ' ' A' ' 6' ' ' LYS . 57.5 mttt -143.87 45.38 1.47 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.379 -179.729 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 57.74 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.605 -179.819 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 4' ' ' LYS . 76.8 mttt -137.04 -167.19 2.04 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 179.736 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.451 ' C ' ' H ' ' A' ' 9' ' ' ARG . 1.1 m-90 72.8 -30.18 0.21 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.14 -179.975 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.492 HD23 ' H ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -68.36 9.67 0.31 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.261 -179.644 . . . . . . . . 3 3 . 1 . 041 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.4 mmt85 60.24 61.7 1.75 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.714 0.292 . . . . 0.0 111.014 179.426 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 25.1 ptt180 -59.27 -50.12 75.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.253 0.549 . . . . 0.0 109.847 179.402 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.47 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 12.4 tt -124.75 -19.17 3.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 178.872 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -55.99 -33.59 60.75 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.281 179.276 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -54.21 -11.61 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.173 0.511 . . . . 0.0 109.747 179.371 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -105.69 -44.04 1.48 Allowed Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.445 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.423 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.1 m -102.41 -38.65 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.944 0.372 . . . . 0.0 111.61 -179.207 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 12' ' ' GLY . 66.8 mttm -73.91 -27.61 61.13 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.732 -179.775 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.407 HG23 ' N ' ' A' ' 18' ' ' ILE . 16.5 tt -43.49 -37.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 121.151 -0.22 . . . . 0.0 111.473 -179.613 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.407 ' N ' HG23 ' A' ' 17' ' ' ILE . 3.1 tp -164.51 17.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 120.922 0.391 . . . . 0.0 110.498 179.979 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -122.92 16.82 8.21 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.666 -0.574 . . . . 0.0 111.666 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -167.42 -38.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.145 -0.55 . . . . 0.0 111.825 179.953 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.41 1.8 2.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.888 0.375 . . . . 0.0 110.303 179.899 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -156.21 -43.77 0.08 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.076 179.961 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.5 mm? -79.85 61.21 3.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.814 179.769 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -162.86 -37.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.521 -179.86 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -73.18 -92.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.492 -179.974 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.57 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.7 mp . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.132 -179.932 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.517 ' N ' ' NH1' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.263 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.497 HH22 ' NH2' ' A' ' 10' ' ' ARG . 88.5 mtt-85 -147.08 86.5 1.64 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.803 0.335 . . . . 0.0 110.405 179.976 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.575 ' H ' ' NE ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -67.01 -74.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.965 179.764 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -76.17 -82.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.432 179.921 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.438 ' NE ' ' HZ1' ' A' ' 6' ' ' LYS . 19.3 ttt85 -169.54 -71.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.504 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 38.0 mttp -145.85 55.77 1.19 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.104 179.612 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 8.7 m-90 -160.45 6.02 0.08 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.269 -179.832 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.585 ' H ' HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.87 -88.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.982 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -171.03 23.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.514 179.563 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' NH2' HH22 ' A' ' 2' ' ' ARG . 0.3 OUTLIER -43.6 -90.07 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.04 179.658 . . . . . . . . 3 3 . 1 . 042 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.554 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.4 pp -98.19 1.32 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.113 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.554 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -70.11 -32.77 69.24 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 178.91 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -50.15 -14.91 0.18 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.048 0.451 . . . . 0.0 109.918 178.78 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.446 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -105.55 -45.45 1.32 Allowed Glycine 0 C--N 1.337 0.59 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.521 -179.6 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.3 m -99.99 -38.31 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 117.058 0.429 . . . . 0.0 111.224 -179.344 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.475 ' N ' ' O ' ' A' ' 12' ' ' GLY . 46.9 tttm -66.4 -42.78 87.33 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 -179.712 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.5 tt -47.95 -20.45 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.645 -179.687 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -135.03 2.5 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.365 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -91.95 -24.43 25.11 Favored Glycine 0 C--N 1.331 0.258 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.825 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.45 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -167.06 -168.01 28.6 Favored Glycine 0 N--CA 1.451 -0.36 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 179.914 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.32 11.53 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.55 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.45 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -169.04 -52.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.315 -179.9 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -81.76 57.29 3.34 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.906 0.384 . . . . 0.0 110.443 179.834 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.497 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 34.3 m-20 -162.35 -58.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.018 -179.947 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.497 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 57.0 p-80 40.94 28.7 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.223 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.554 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.107 -179.911 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.512 ' N ' ' CD ' ' A' ' 2' ' ' ARG . 10.2 mpt_? -72.71 73.67 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.369 . . . . 0.0 110.202 179.926 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -70.2 -38.29 75.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.596 -179.878 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mtpt -145.25 44.6 1.32 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.461 -179.918 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 55.22 34.65 23.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.499 179.92 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 54.03 80.73 0.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.638 179.997 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 25.4 t90 -166.29 10.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.111 179.905 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.674 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.7 pt? -75.84 23.87 0.13 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.069 -179.86 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.4 mmt85 62.21 38.59 13.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.43 179.912 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -46.5 -92.71 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.461 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.521 ' CD1' ' H ' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -85.21 -1.06 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.761 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -69.94 -44.84 60.05 Favored Glycine 0 C--N 1.336 0.566 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.766 -179.894 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -45.54 -17.44 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.268 0.556 . . . . 0.0 110.129 178.938 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -94.78 -45.03 3.24 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.031 -179.935 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.48 ' O ' ' N ' ' A' ' 19' ' ' GLY . 25.8 m -108.83 -40.92 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 120.763 0.316 . . . . 0.0 110.564 -179.965 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.556 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.9 tptm -66.1 -41.11 91.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.884 179.824 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.0 tt -41.07 -25.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.4 -179.616 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.554 HG23 ' N ' ' A' ' 19' ' ' GLY . 15.0 tt -164.83 -48.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.942 179.451 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.554 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 164.62 -15.79 0.1 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.024 179.965 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.64 -32.38 1.21 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 121.148 -0.549 . . . . 0.0 111.911 -179.946 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.422 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -50.49 -51.97 42.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.834 0.349 . . . . 0.0 110.432 179.864 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.66 -40.12 61.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.355 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.467 ' O ' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -61.27 -14.59 27.47 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.84 -179.988 . . . . . . . . 3 3 . 1 . 043 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -162.83 62.87 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 -179.994 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -72.87 8.96 1.28 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.65 -179.886 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.3 mt . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.329 179.827 . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.937 -0.465 . . . . 0.0 111.937 . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -75.15 72.3 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.801 0.334 . . . . 0.0 110.458 -179.975 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.5 mmt85 -73.39 -21.2 60.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.341 -179.956 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 6' ' ' LYS . 42.9 mttp -146.02 42.52 1.22 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.118 179.934 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 53.84 -88.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.522 -179.899 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.587 ' NZ ' ' NH2' ' A' ' 10' ' ' ARG . 50.5 mttm -146.38 59.11 1.22 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.506 -179.931 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -126.87 -4.66 6.35 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.872 179.649 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -86.61 10.47 15.44 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.142 179.658 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 59.78 48.55 9.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.065 179.515 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.587 ' NH2' ' NZ ' ' A' ' 6' ' ' LYS . 1.3 ptp180 -51.38 -76.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.86 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.1 tt -98.42 -13.71 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.424 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.62 -43.81 78.95 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.459 179.728 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -47.82 -16.83 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.177 0.513 . . . . 0.0 109.998 179.153 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.76 -41.81 3.26 Favored Glycine 0 C--N 1.334 0.47 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.258 179.946 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.1 m -106.05 -44.75 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 117.048 0.424 . . . . 0.0 111.32 -179.534 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 12' ' ' GLY . 32.6 mmtm -58.11 -33.53 69.23 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.838 179.926 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.9 tt -61.13 -2.25 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.162 179.498 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.1 mt 64.98 88.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.325 -179.851 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.46 29.28 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.967 -179.942 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -176.86 -152.57 9.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.054 -179.921 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.44 -91.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.776 0.322 . . . . 0.0 110.233 -179.805 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -74.89 -39.07 61.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.265 179.681 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.595 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.7 mp -78.49 72.33 5.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.998 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -170.45 -24.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.541 -179.965 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -78.22 47.02 0.65 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.504 -179.955 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.443 179.934 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.222 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.1 ptp85 -166.14 -8.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.75 0.31 . . . . 0.0 110.475 179.983 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.46 ' C ' ' H ' ' A' ' 5' ' ' ARG . 17.9 mmm180 -53.73 94.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.731 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' CD ' ' N ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER 55.85 6.86 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.419 -179.527 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 3' ' ' ARG . 12.7 tpt85 -87.59 81.72 7.65 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.404 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt 57.03 55.92 5.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.253 -179.45 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 71.4 t-105 -164.29 1.94 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.175 -179.858 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.511 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.14 -79.64 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 -179.583 . . . . . . . . 3 3 . 1 . 045 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 mmt85 -151.07 17.96 0.76 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.777 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.3 ptt85 -41.33 -88.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.456 -179.815 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.7 tt -82.58 -16.82 11.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.277 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.61 -41.26 93.53 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.301 179.659 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -50.75 -18.06 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 109.359 178.717 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.13 -44.3 3.58 Favored Glycine 0 C--N 1.335 0.516 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.456 179.898 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.1 m -104.31 -44.03 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 116.998 0.399 . . . . 0.0 110.869 -179.63 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' N ' ' O ' ' A' ' 12' ' ' GLY . 76.9 tttt -58.24 -32.54 68.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.792 0.329 . . . . 0.0 110.333 179.84 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.3 tt -61.75 -0.86 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.339 179.73 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.472 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 64.36 79.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.281 -179.931 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.83 -2.13 90.64 Favored Glycine 0 C--N 1.332 0.347 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.024 -179.962 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.442 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 175.13 12.01 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.24 -179.991 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 47.85 18.33 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.398 -179.707 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.442 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -156.81 -27.91 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.252 179.762 . . . . . . . . 2 2 . 1 . 045 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.8 tp -82.74 57.19 3.68 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.459 179.262 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 p-10 -145.53 -12.07 0.52 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.577 -179.216 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -81.53 30.1 0.36 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.772 -179.934 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.069 -179.987 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.021 -0.431 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -75.22 119.79 19.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.774 0.321 . . . . 0.0 110.524 179.999 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -166.36 -17.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.909 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -138.9 37.88 2.16 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.328 179.988 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.403 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER 49.94 44.12 25.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.525 179.903 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 54.9 mttm 55.01 77.42 0.21 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.045 179.614 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 79.1 m95 -162.57 12.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.699 179.556 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.518 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -59.98 -91.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.162 179.974 . . . . . . . . 3 3 . 1 . 046 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.452 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 22.9 mmt180 -143.31 15.38 1.85 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.708 -179.632 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -45.35 -87.0 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.883 179.789 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 pt -93.43 -10.23 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.839 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.07 -34.25 65.89 Favored Glycine 0 N--CA 1.45 -0.412 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 179.756 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.9 ttpp -50.08 -16.41 0.3 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.037 0.446 . . . . 0.0 109.968 179.178 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.433 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.66 -44.36 1.56 Allowed Glycine 0 C--N 1.335 0.488 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.667 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.9 m -102.65 -37.82 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-N 116.971 0.386 . . . . 0.0 111.307 -179.336 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' N ' ' O ' ' A' ' 12' ' ' GLY . 83.7 tttt -71.35 -34.99 70.99 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.9 -179.644 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.2 tt -50.82 -36.66 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.457 -179.712 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.79 -64.75 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.616 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 168.44 -12.41 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.452 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.14 -60.55 3.1 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.356 -0.449 . . . . 0.0 112.129 179.907 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.89 -47.14 60.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.86 0.362 . . . . 0.0 110.726 -179.877 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.87 -7.23 57.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.801 -179.829 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.3 tp -138.2 66.69 1.43 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.898 0.38 . . . . 0.0 110.191 179.89 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 26' ' ' LEU . 28.2 t70 -169.45 -24.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.07 179.965 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.46 30.94 0.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.888 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.8 mp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.112 179.988 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -77.98 71.07 4.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.294 . . . . 0.0 110.651 180.0 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -74.32 -24.89 59.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.47 -179.945 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -142.41 -88.74 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.486 179.982 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.6 mtp85 -155.03 -69.79 0.12 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.741 0.305 . . . . 0.0 110.371 -179.981 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -159.17 49.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.37 -179.805 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.497 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 93.3 m95 -160.09 11.82 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.765 179.924 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.538 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.08 -69.8 0.12 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.122 -179.898 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -166.92 20.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.17 179.913 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -43.0 -89.82 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.755 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.9 pt -89.31 -8.64 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.973 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.94 -41.3 96.21 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 179.977 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -48.6 -16.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.114 0.483 . . . . 0.0 110.008 179.105 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.81 -41.79 2.81 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.488 -179.915 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.2 m -109.0 -41.39 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 116.924 0.362 . . . . 0.0 111.39 -179.284 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . 87.7 tttt -54.38 -53.99 46.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.569 -179.592 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.3 tt -70.04 4.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 109.859 179.766 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.8 mt 60.69 70.54 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.294 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.98 107.23 2.1 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.167 -0.54 . . . . 0.0 112.055 -179.912 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -57.59 -14.58 14.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.87 179.872 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.28 13.29 0.59 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.351 . . . . 0.0 110.465 179.902 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -161.44 -46.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.293 179.963 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.49 62.53 3.12 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.231 0.538 . . . . 0.0 109.741 179.872 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -171.87 -53.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.449 -179.795 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -76.84 99.97 5.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.554 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.4 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.051 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.1 mmt85 -73.38 84.24 1.45 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.915 0.388 . . . . 0.0 110.655 -179.933 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.424 ' C ' ' H ' ' A' ' 5' ' ' ARG . 57.4 mtp85 52.06 -93.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.912 179.788 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -76.97 27.41 0.14 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.597 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.424 ' H ' ' C ' ' A' ' 3' ' ' ARG . 23.4 mmt180 51.01 62.02 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.566 179.816 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm 52.1 82.3 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.893 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.424 ' H ' HD23 ' A' ' 8' ' ' LEU . 28.4 t90 -167.86 8.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.397 -179.94 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.584 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.63 -89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.751 . . . . . . . . 3 3 . 1 . 048 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -166.92 22.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.817 179.548 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.57 -90.05 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.598 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 tt -78.81 -17.14 13.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.009 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.71 -46.18 83.18 Favored Glycine 0 C--O 1.221 -0.658 0 C-N-CA 120.829 -0.701 . . . . 0.0 111.909 179.977 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 43.1 pttt -47.31 -17.77 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.734 -0.862 . . . . 0.0 109.356 178.486 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.5 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -86.21 -52.08 3.35 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.819 179.415 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -92.38 -43.07 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.556 ' N ' ' O ' ' A' ' 12' ' ' GLY . 77.7 tttt -53.4 -48.58 68.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.462 179.006 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' CG2' ' O ' ' A' ' 13' ' ' LYS . 9.0 tt -65.15 4.42 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.218 179.849 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.51 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.4 mt 63.78 91.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.345 -179.749 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -157.37 -47.02 0.01 OUTLIER Glycine 0 C--N 1.333 0.364 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.945 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.2 -44.43 8.08 Favored Glycine 0 C--N 1.33 0.242 0 N-CA-C 111.856 -0.498 . . . . 0.0 111.856 179.847 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -44.65 -58.82 2.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.85 0.357 . . . . 0.0 110.992 -179.874 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.09 -45.04 82.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.481 -179.943 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.5 mt -85.91 48.32 1.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.693 -179.971 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -167.32 -38.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.41 179.714 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -61.3 -77.02 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.397 179.728 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.351 179.807 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 049 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -76.17 65.19 2.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.779 0.323 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -77.36 -24.16 50.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.595 -179.956 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -169.94 50.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 -179.916 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.1 mtm180 44.12 -155.24 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 -179.87 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.518 ' C ' ' HE ' ' A' ' 10' ' ' ARG . 64.3 mmtt -80.34 78.74 7.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.245 179.591 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.455 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 63.7 t-105 -171.55 3.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.383 -179.831 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.582 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -55.18 -84.59 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.185 -179.523 . . . . . . . . 3 3 . 1 . 049 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 mmm-85 -143.64 17.21 1.82 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 110.556 -0.164 . . . . 0.0 110.556 -179.806 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.518 ' HE ' ' C ' ' A' ' 6' ' ' LYS . 4.6 ptt180 -47.95 -86.63 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.965 179.942 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.1 mm -89.85 -12.05 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.285 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.47 -39.33 90.49 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 179.561 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -53.13 -13.0 0.42 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.841 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.454 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.51 -44.44 1.69 Allowed Glycine 0 C--N 1.335 0.52 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.143 179.899 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.6 m -102.79 -40.52 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 116.887 0.343 . . . . 0.0 111.311 -179.576 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 10.0 ttmm -55.88 -51.78 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.5 -179.83 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.7 tt -67.4 5.7 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 -179.856 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.467 ' H ' ' C ' ' A' ' 16' ' ' LYS . 17.7 mt 61.36 88.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.338 179.944 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.4 89.52 0.92 Allowed Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.958 179.94 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.441 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -56.91 -160.1 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.807 -179.97 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.97 12.5 0.2 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.907 0.384 . . . . 0.0 110.359 -179.92 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.441 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -170.36 -57.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.264 -179.935 . . . . . . . . 2 2 . 1 . 049 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.7 tp -85.83 49.73 1.83 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.329 179.847 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -167.24 -53.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 2.9 t60 52.77 97.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.974 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.47 179.856 . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.253 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 . . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -61.66 92.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.815 0.341 . . . . 0.0 110.659 -179.968 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -61.01 -29.44 69.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.229 179.745 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -167.93 59.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.315 -179.891 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 59.19 -163.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.353 -179.728 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -80.64 87.88 5.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 -179.607 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.47 ' C ' ' H ' ' A' ' 9' ' ' ARG . 45.2 t-105 -166.8 0.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.246 179.832 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.746 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.9 pt? -73.4 29.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.402 -179.768 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.47 ' H ' ' C ' ' A' ' 7' ' ' TRP . 41.1 mmm-85 62.85 40.58 9.55 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.854 0.359 . . . . 0.0 110.568 179.835 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -52.2 -89.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.718 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -76.15 -22.27 15.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.587 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.27 -43.46 75.18 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 179.565 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -46.02 -17.67 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.094 0.474 . . . . 0.0 110.146 178.947 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.461 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.11 -44.25 2.64 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.36 179.971 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.65 -43.67 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 117.155 0.478 . . . . 0.0 111.299 -179.544 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 12' ' ' GLY . 19.4 mmtp -61.02 -31.87 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.379 -0.528 . . . . 0.0 109.991 179.868 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.5 tp -65.48 -0.62 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.451 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.431 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.3 mt 62.65 78.17 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.345 -179.722 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 172.12 47.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.796 179.976 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -166.59 -67.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.249 -0.501 . . . . 0.0 111.94 -179.921 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.76 -56.09 24.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.786 0.327 . . . . 0.0 110.36 179.92 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.26 -22.46 63.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.283 179.823 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.66 -25.9 60.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.211 179.925 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -160.65 68.08 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.376 179.984 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.7 p-80 -58.27 153.96 14.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.564 -179.846 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.561 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.759 -179.937 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 051 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 51.13 70.17 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.802 0.334 . . . . 0.0 110.583 -180.0 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.692 ' HE ' HH22 ' A' ' 9' ' ' ARG . 67.2 ttp85 -58.93 -29.47 67.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.536 -179.982 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -165.81 70.87 0.14 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.655 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 51.16 -108.74 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 179.708 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 97.4 mttt -146.04 72.48 1.3 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.731 0.301 . . . . 0.0 110.49 -179.794 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 4.1 m-90 -162.22 9.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.87 179.815 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -78.01 -89.73 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.747 179.831 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.692 HH22 ' HE ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -171.73 23.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.583 179.818 . . . . . . . . 3 3 . 1 . 051 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -44.26 -90.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.134 179.618 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.8 mm -81.7 -14.73 12.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.395 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.511 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.81 -41.96 96.28 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.443 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -50.77 -15.07 0.24 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.308 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.461 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.65 -45.81 1.89 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.229 179.931 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -101.68 -41.42 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.993 0.397 . . . . 0.0 110.998 -179.683 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.511 ' N ' ' O ' ' A' ' 12' ' ' GLY . 80.5 tttt -57.65 -40.25 78.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.759 0.314 . . . . 0.0 110.374 179.941 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -67.34 2.41 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.071 0.462 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.428 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.6 mt 60.33 72.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.41 -179.891 . . . . . . . . 2 2 . 1 . 051 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.41 11.41 9.26 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.263 -0.494 . . . . 0.0 112.05 -179.969 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.9 -39.31 1.57 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.012 179.948 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.44 87.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.85 0.357 . . . . 0.0 110.468 -179.939 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.17 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.409 179.931 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 tp -77.06 40.98 0.27 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.4 -179.902 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -167.62 -28.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.677 -179.891 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 83.2 t60 55.34 90.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 179.991 . . . . . . . . 1 1 . 1 . 051 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.118 -179.982 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 052 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 mmt-85 -71.53 75.54 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.519 179.971 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.5 ttp85 -68.61 -15.7 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.321 179.842 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -155.5 -89.94 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.391 179.99 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -171.97 71.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.818 0.342 . . . . 0.0 110.39 179.985 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.0 mttt 52.61 61.51 3.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.435 -179.954 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.48 ' CE3' ' O ' ' A' ' 7' ' ' TRP . 77.5 t90 -162.74 -10.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.961 179.928 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.754 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -63.18 3.63 0.26 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.482 -179.841 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.452 ' H ' ' C ' ' A' ' 7' ' ' TRP . 19.0 mmt180 62.11 40.05 12.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.723 0.297 . . . . 0.0 110.774 179.982 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -50.56 -92.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.174 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.546 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.4 pp -93.02 1.97 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.834 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.546 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -71.3 -37.38 63.15 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.702 -0.959 . . . . 0.0 110.702 179.27 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -51.17 -15.61 0.38 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.73 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.35 -41.92 3.33 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.434 -179.779 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.6 m -110.95 -41.57 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.872 0.336 . . . . 0.0 111.096 -179.472 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 36.7 ttmt -59.45 -32.65 70.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.8 tp -70.45 7.33 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.129 179.882 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' H ' ' C ' ' A' ' 16' ' ' LYS . 18.6 mt 59.3 93.66 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.131 -179.651 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.12 -2.29 0.04 OUTLIER Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.281 -0.485 . . . . 0.0 111.9 -179.98 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -172.42 173.72 45.4 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.154 -0.546 . . . . 0.0 111.822 179.916 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.52 10.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.893 0.378 . . . . 0.0 110.267 -179.803 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -169.54 0.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.398 -179.96 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.424 ' H ' ' H ' ' A' ' 22' ' ' ALA . 7.3 tp -153.38 49.18 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.384 179.923 . . . . . . . . 2 2 . 1 . 052 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -171.54 10.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.528 179.959 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -62.55 140.18 58.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.881 . . . . . . . . 1 1 . 1 . 052 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.505 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.1 mm? . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.095 179.982 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 053 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.653 ' H ' ' NE ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER 52.24 98.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.806 0.336 . . . . 0.0 110.181 -179.954 . . . . . . . . 3 3 . 1 . 053 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -61.17 -24.34 66.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.633 -179.978 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -167.31 50.66 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 -179.885 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 69.3 -153.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.905 -179.902 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.49 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 52.4 mmtt -88.14 66.67 8.61 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.791 0.329 . . . . 0.0 110.679 179.944 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 85.9 m95 -155.83 6.15 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.854 179.705 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.585 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.5 pt? -74.79 18.34 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 -179.94 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 7' ' ' TRP . 14.6 mmt85 63.19 42.33 7.21 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.022 179.752 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -52.67 -91.46 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.648 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 tt -82.1 -16.14 11.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.47 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.09 -40.37 82.85 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.552 179.767 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -49.2 -15.71 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.001 179.058 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.02 -43.53 2.21 Favored Glycine 0 C--N 1.336 0.569 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.516 -179.903 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.9 m -104.05 -40.93 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 117.051 0.425 . . . . 0.0 111.041 -179.639 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.501 ' N ' ' O ' ' A' ' 12' ' ' GLY . 17.6 tptp -59.98 -40.45 89.17 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.563 -179.839 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.429 HG23 ' N ' ' A' ' 18' ' ' ILE . 16.3 tt -53.94 -38.86 38.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.285 179.901 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.429 ' N ' HG23 ' A' ' 17' ' ' ILE . 12.7 mt -75.94 -69.63 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.186 179.629 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -176.97 50.74 0.11 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 111.514 -0.634 . . . . 0.0 111.514 -179.991 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.09 -22.24 0.11 Allowed Glycine 0 C--N 1.331 0.294 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.474 -179.793 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.427 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -55.8 -68.74 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.819 0.343 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.26 -42.87 22.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.32 179.873 . . . . . . . . 1 1 . 1 . 053 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.39 75.89 1.9 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.228 0.537 . . . . 0.0 109.714 179.952 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' A' ' 25' ' ' HIS . 38.4 p-10 -173.34 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.945 -179.763 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.43 ' N ' ' OD1' ' A' ' 24' ' ' ASP . 84.5 t60 -56.78 103.2 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.523 179.939 . . . . . . . . 2 2 . 1 . 053 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.323 -179.956 . . . . . . . . 0 0 . 1 . 054 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 4' ' ' LYS . 65.7 mtt-85 58.68 -77.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.654 0.264 . . . . 0.0 110.878 179.92 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 1' ' ' GLY . 98.7 mtt180 54.26 -88.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 6' ' ' LYS . 12.1 mptt -76.71 17.17 0.43 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.263 179.933 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.414 ' H ' ' C ' ' A' ' 3' ' ' ARG . 76.2 mtm180 58.2 -78.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.717 -179.838 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.9 mttm -145.32 65.05 1.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.784 0.326 . . . . 0.0 110.519 -179.907 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.476 ' H ' HD23 ' A' ' 8' ' ' LEU . 54.1 t-105 -171.0 21.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.384 179.793 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.531 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -74.9 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.09 179.95 . . . . . . . . 3 3 . 1 . 054 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -153.57 16.86 0.53 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.886 -179.872 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.567 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 4.7 ptm180 -46.37 -62.49 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.258 -179.789 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.567 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 10.7 tp -113.57 -16.68 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.556 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.53 -31.42 57.31 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.625 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -53.93 -27.24 29.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.312 0.577 . . . . 0.0 109.703 179.136 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -89.9 -30.2 13.62 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.493 -179.571 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' GLY . 20.4 m -124.4 -48.57 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.285 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 54.6 tttm -48.66 -52.06 25.2 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.174 -179.095 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.473 HG23 ' N ' ' A' ' 18' ' ' ILE . 14.8 tt -68.68 -42.36 83.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.142 179.717 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' N ' HG23 ' A' ' 17' ' ' ILE . 26.4 mt -134.67 84.19 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.92 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 154.49 -8.86 0.39 Allowed Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.553 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -159.41 -134.79 1.74 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.809 -0.517 . . . . 0.0 111.809 -179.988 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.83 -106.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.388 -179.9 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.4 -40.34 93.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.935 0.398 . . . . 0.0 110.171 179.685 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.3 mp -82.94 68.69 9.54 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 054 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -167.65 -40.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -70.64 -82.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.587 -179.838 . . . . . . . . 1 1 . 1 . 054 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.57 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.5 mp . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 055 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.735 ' H ' ' HE ' ' A' ' 2' ' ' ARG . 0.2 OUTLIER -82.79 -176.3 6.22 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 179.967 . . . . . . . . 3 3 . 1 . 055 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 55.9 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 2' ' ' ARG . 56.2 tttp -149.55 59.79 1.01 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 110.085 179.87 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.7 mtt-85 53.05 -109.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.772 179.955 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -146.1 74.23 1.36 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 110.455 -179.918 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.417 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 73.5 t-105 -167.92 2.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.475 179.966 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.514 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -58.53 -91.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.075 179.751 . . . . . . . . 3 3 . 1 . 055 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.462 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 28.3 mmt180 -139.49 13.08 2.55 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.662 -179.81 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.93 -87.61 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.447 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.4 ' H ' HG13 ' A' ' 11' ' ' ILE . 2.5 pp -89.96 -9.28 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.34 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.33 -42.22 88.55 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 179.546 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.86 -13.78 0.31 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.949 0.404 . . . . 0.0 109.989 179.435 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.0 -31.62 5.3 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.409 -179.681 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.414 HG23 ' N ' ' A' ' 16' ' ' LYS . 21.1 m -122.03 -41.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 116.771 0.286 . . . . 0.0 111.328 -179.371 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' A' ' 12' ' ' GLY . 63.5 tttm -55.39 -52.08 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.934 -179.669 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.481 HG23 ' N ' ' A' ' 18' ' ' ILE . 18.9 tt -58.48 -42.33 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.719 -179.677 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.481 ' N ' HG23 ' A' ' 17' ' ' ILE . 6.6 mt -73.91 -20.06 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.049 0.452 . . . . 0.0 110.174 179.757 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.27 -14.79 0.95 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.225 -0.512 . . . . 0.0 112.061 -179.946 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.09 -45.61 2.3 Favored Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.754 -0.538 . . . . 0.0 111.754 -179.873 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.88 -39.89 66.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.908 0.385 . . . . 0.0 109.986 179.649 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.75 -49.06 15.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.993 179.515 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.5 tp -80.27 62.3 4.37 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.262 179.724 . . . . . . . . 1 1 . 1 . 055 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.408 ' H ' ' H ' ' A' ' 25' ' ' HIS . 40.4 t0 -165.52 -0.22 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.678 179.976 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' ASP . 2.6 t60 -73.63 112.2 9.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.506 -179.987 . . . . . . . . 2 2 . 1 . 055 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.097 179.984 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 111.946 -0.462 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 056 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.797 HH22 ' HZ3' ' A' ' 6' ' ' LYS . 46.3 mtt-85 -75.06 81.26 2.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 0.0 110.606 179.964 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.15 -36.43 83.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.628 -179.916 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -171.17 67.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.577 179.981 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.3 mmm-85 53.95 175.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.385 179.99 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.797 ' HZ3' HH22 ' A' ' 2' ' ' ARG . 62.2 mmtt -58.95 91.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.551 -179.981 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.447 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 76.1 t-105 -171.1 4.78 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.696 179.866 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.563 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -72.41 -94.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.838 . . . . . . . . 3 3 . 1 . 056 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.95 25.8 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.554 -179.914 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -44.36 -90.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.513 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.9 pt -81.12 -15.25 12.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.627 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.2 -38.94 91.54 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.472 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ttpp -45.68 -20.56 0.08 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.154 0.502 . . . . 0.0 109.979 178.525 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.07 -46.05 2.71 Favored Glycine 0 C--N 1.336 0.555 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.48 -179.875 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.58 -42.89 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 116.948 0.374 . . . . 0.0 111.04 -179.568 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.3 tttp -58.16 -35.74 71.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.715 0.293 . . . . 0.0 110.608 179.965 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.37 0.76 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.017 0.437 . . . . 0.0 110.393 179.998 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.1 mt 62.84 76.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.469 179.897 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -85.64 34.95 3.25 Favored Glycine 0 C--N 1.332 0.322 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.941 179.94 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.2 -35.1 1.1 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.25 -0.5 . . . . 0.0 111.879 -179.938 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.42 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -58.31 -52.65 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 0.0 110.435 179.989 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.75 -31.41 71.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.342 179.79 . . . . . . . . 1 1 . 1 . 056 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.64 72.39 1.02 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.229 0.538 . . . . 0.0 109.63 179.818 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' H ' ' H ' ' A' ' 25' ' ' HIS . 29.7 t70 -172.23 -9.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.057 -179.728 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.431 ' H ' ' H ' ' A' ' 24' ' ' ASP . 39.6 p-80 -49.13 134.39 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.733 -179.893 . . . . . . . . 2 2 . 1 . 056 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.5 mt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.476 179.923 . . . . . . . . 0 0 . 1 . 057 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 057 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -73.2 111.71 8.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.449 -179.991 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -71.2 -58.11 3.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 -179.916 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -141.21 36.38 1.71 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.165 -179.928 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 53.57 -164.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.058 -179.599 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -78.75 69.85 4.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.463 179.838 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.423 ' HE1' ' NZ ' ' A' ' 16' ' ' LYS . 50.5 t-105 -167.06 6.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.841 -179.854 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.548 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.02 -80.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.339 -179.903 . . . . . . . . 3 3 . 1 . 057 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.5 mmt85 -147.67 14.84 1.09 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.965 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -46.34 -87.34 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.135 179.679 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.5 tt -82.67 -20.24 9.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.054 179.423 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.46 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -53.55 -39.33 60.13 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.353 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -45.27 -19.37 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 0.0 110.292 178.974 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.2 -44.98 2.1 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.758 -179.545 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.4 m -99.57 -40.62 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 117.395 0.598 . . . . 0.0 111.676 -179.223 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' N ' ' O ' ' A' ' 12' ' ' GLY . 25.0 mmtm -64.1 -39.68 94.58 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.507 -179.928 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.402 HG23 HG22 ' A' ' 18' ' ' ILE . 4.7 tp -48.81 -34.52 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.885 -179.597 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.694 ' O ' HG23 ' A' ' 18' ' ' ILE . 5.3 tp -165.35 58.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.329 0.585 . . . . 0.0 110.54 179.963 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.5 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -169.5 -10.69 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.994 179.963 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -45.36 166.78 0.04 OUTLIER Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.239 -179.961 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.45 16.91 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.815 0.341 . . . . 0.0 110.686 -179.915 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -159.94 -33.46 0.06 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.134 179.946 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.8 mt -76.37 15.99 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.239 179.824 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 22' ' ' ALA . 39.2 t70 -161.06 1.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.244 -179.983 . . . . . . . . 2 2 . 1 . 057 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 52.63 26.83 4.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.593 -179.967 . . . . . . . . 1 1 . 1 . 057 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.491 179.953 . . . . . . . . 0 0 . 1 . 058 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 111.991 -0.443 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 058 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 -148.19 -10.81 0.37 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.811 0.339 . . . . 0.0 110.236 179.989 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ptm85 -61.24 -38.05 85.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.563 -179.821 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 6' ' ' LYS . 53.8 mttp -84.85 34.11 0.54 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.778 0.323 . . . . 0.0 110.267 179.661 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.5 mtt-85 53.41 -86.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.612 -179.986 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 4' ' ' LYS . 88.1 mttt -145.56 62.42 1.27 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.992 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.533 ' H ' HD13 ' A' ' 8' ' ' LEU . 95.3 m95 -155.84 17.3 0.37 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.63 -179.81 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.033 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -75.06 33.13 0.1 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.834 179.804 . . . . . . . . 3 3 . 1 . 058 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.453 ' H ' ' C ' ' A' ' 7' ' ' TRP . 12.0 mmt85 65.48 36.77 6.48 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.518 179.748 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.7 ptt85 -51.96 -91.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.147 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -85.43 -17.23 9.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.197 179.572 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.99 -40.29 81.79 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.613 -0.804 . . . . 0.0 111.401 179.714 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -50.03 -14.4 0.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.868 0.366 . . . . 0.0 110.096 179.307 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.431 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.33 -37.74 3.23 Favored Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.493 -179.777 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -111.05 -42.37 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.857 0.329 . . . . 0.0 111.104 -179.486 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.3 tttt -52.89 -51.63 60.51 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.754 -179.709 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.3 pt -42.88 -40.48 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.961 -179.825 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.501 ' O ' HG23 ' A' ' 18' ' ' ILE . 13.3 tt -173.66 86.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 109.925 179.786 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.85 -18.53 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.459 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -147.66 -170.93 16.21 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 111.775 -0.53 . . . . 0.0 111.775 179.825 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.49 -87.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.759 0.314 . . . . 0.0 110.469 -179.86 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -64.43 -26.45 68.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.24 179.914 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -83.82 31.71 0.48 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.109 179.902 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 26' ' ' LEU . 2.9 p30 -163.64 -18.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.599 179.893 . . . . . . . . 2 2 . 1 . 058 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 58.59 -77.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.791 179.941 . . . . . . . . 1 1 . 1 . 058 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 24' ' ' ASP . 37.4 mt . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.722 0.296 . . . . 0.0 110.423 179.99 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -76.61 27.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.603 0.24 . . . . 0.0 110.758 -179.973 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.435 ' H ' ' C ' ' A' ' 1' ' ' GLY . 6.4 mmp_? -50.22 -20.7 1.1 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.238 0.542 . . . . 0.0 109.81 179.454 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' NZ ' ' CB ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -165.57 177.44 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.689 179.498 . . . . . . . . 3 3 . 1 . 059 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -83.54 131.44 34.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttt 43.12 92.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.906 178.682 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.402 ' O ' ' O ' ' A' ' 8' ' ' LEU . 68.2 t-105 -174.79 -34.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.134 179.129 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.521 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -36.94 -95.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.482 -179.748 . . . . . . . . 3 3 . 1 . 059 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.502 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 3.0 tpt180 -167.83 33.59 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.906 0.384 . . . . 0.0 110.567 -179.735 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -90.55 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.971 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.9 pt -82.8 -13.89 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.771 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -51.39 -48.85 47.15 Favored Glycine 0 C--N 1.333 0.362 0 N-CA-C 111.346 -0.701 . . . . 0.0 111.346 179.85 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -40.81 -23.55 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.027 0.441 . . . . 0.0 110.436 179.062 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -91.66 -42.63 4.75 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.425 179.917 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.4 m -107.24 -45.02 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 117.0 0.4 . . . . 0.0 111.122 -179.566 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 60.4 tttm -57.29 -28.73 63.29 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.315 -179.903 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.8 tt -65.41 1.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.973 0.416 . . . . 0.0 110.072 179.592 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 19.2 mt 63.58 92.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.277 -179.916 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -177.25 10.15 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 -179.986 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -159.51 -43.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 179.957 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.83 71.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.85 0.357 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.72 -26.06 57.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.308 179.789 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.551 ' N ' HD12 ' A' ' 23' ' ' LEU . 7.9 mp -77.91 44.2 0.46 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.965 179.908 . . . . . . . . 2 2 . 1 . 059 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -161.88 -39.68 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.474 -179.917 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 52.34 99.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.473 179.914 . . . . . . . . 1 1 . 1 . 059 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.509 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.2 mm? . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.145 -179.932 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.229 0 N-CA-C 111.949 -0.46 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 060 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.4 mmt-85 -76.53 96.32 4.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.817 0.342 . . . . 0.0 110.477 179.968 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 50.4 ttt85 -74.04 -75.15 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.927 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -93.11 28.59 2.1 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.821 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 56.26 75.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.634 179.842 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 49.08 65.61 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 179.863 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -170.83 15.76 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.45 179.869 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.567 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.85 -70.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 0.0 109.998 -179.926 . . . . . . . . 3 3 . 1 . 060 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -169.27 21.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -42.63 -90.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.552 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.2 pp -95.55 0.66 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.54 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.552 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -72.08 -35.8 60.84 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.393 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -11.41 1.0 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.875 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.57 -40.46 3.17 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.367 -179.84 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' N ' ' A' ' 16' ' ' LYS . 26.4 m -113.4 -39.73 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 116.775 0.288 . . . . 0.0 111.213 -179.445 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.9 ttpt -71.03 -23.5 62.18 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.041 -179.696 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.518 HG23 ' N ' ' A' ' 18' ' ' ILE . 16.2 tt -56.8 -44.65 82.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.347 -179.387 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.518 ' N ' HG23 ' A' ' 17' ' ' ILE . 3.4 tp -165.09 31.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 120.988 0.423 . . . . 0.0 110.936 -179.845 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -153.13 28.85 0.8 Allowed Glycine 0 C--N 1.331 0.264 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 179.926 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.402 ' O ' ' OD1' ' A' ' 24' ' ' ASP . . . -155.74 -52.13 0.01 OUTLIER Glycine 0 C--N 1.331 0.297 0 N-CA-C 111.646 -0.581 . . . . 0.0 111.646 -179.911 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.73 -60.2 3.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.8 0.333 . . . . 0.0 110.669 179.98 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.63 24.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.997 -179.767 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tp -76.81 62.49 2.05 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.691 -179.602 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.402 ' OD1' ' O ' ' A' ' 20' ' ' GLY . 54.1 m-20 -161.99 -8.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.17 179.786 . . . . . . . . 2 2 . 1 . 060 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -70.05 -47.65 61.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.533 179.993 . . . . . . . . 1 1 . 1 . 060 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.524 179.947 . . . . . . . . 0 0 . 1 . 061 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.419 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.202 0 N-CA-C 111.87 -0.492 . . . . 0.0 111.87 . . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -77.21 35.31 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.769 0.318 . . . . 0.0 110.617 -179.929 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 1' ' ' GLY . 68.6 ttt-85 -73.57 -34.73 65.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.601 179.938 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 6' ' ' LYS . 59.1 tttm -169.81 67.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 179.974 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.519 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER 48.62 -92.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.4 179.852 . . . . . . . . 3 3 . 1 . 061 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' N ' ' O ' ' A' ' 4' ' ' LYS . 49.5 mtmt -149.25 89.25 1.64 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.114 -179.829 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' C ' ' H ' ' A' ' 9' ' ' ARG . 66.9 t-105 -163.76 -15.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.344 -179.935 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.794 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.9 pt? -61.4 1.02 0.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.431 -179.982 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.1 mmt85 63.2 38.65 10.38 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.178 179.767 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -54.98 -91.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.882 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.7 tt -88.52 -14.05 9.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 178.993 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.07 -38.42 66.12 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 179.307 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -45.66 -21.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.361 0.6 . . . . 0.0 109.931 178.825 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.441 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.9 -45.19 2.93 Favored Glycine 0 C--N 1.332 0.315 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.598 -179.859 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -103.18 -41.91 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 117.053 0.427 . . . . 0.0 111.694 -179.15 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 12' ' ' GLY . 63.2 tttm -53.06 -56.85 13.02 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.76 -179.495 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.48 2.21 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.071 0.462 . . . . 0.0 109.97 179.792 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.2 mt 61.03 92.97 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 -179.513 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.98 111.63 4.28 Favored Glycine 0 C--N 1.334 0.453 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.75 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 24' ' ' ASP . . . 50.68 68.03 1.65 Allowed Glycine 0 C--O 1.225 -0.464 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -179.406 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.417 ' C ' ' H ' ' A' ' 23' ' ' LEU . . . 56.97 22.76 7.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.256 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 66.65 0.84 1.97 Allowed 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.93 -178.996 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' A' ' 21' ' ' ALA . 11.0 tp -171.32 62.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.672 179.378 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.521 ' N ' ' O ' ' A' ' 20' ' ' GLY . 15.9 t70 -174.58 15.93 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.617 . . . . . . . . 2 2 . 1 . 061 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -77.04 7.39 4.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.951 -179.374 . . . . . . . . 1 1 . 1 . 061 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 26' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.041 179.941 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 062 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -174.3 41.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.786 0.327 . . . . 0.0 110.5 -179.909 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -55.15 -31.12 61.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -162.27 69.62 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.652 -179.888 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 53.93 -106.66 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.668 179.974 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 65.3 mttm -148.71 61.85 1.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.324 -179.843 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.512 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 95.2 m95 -159.87 17.94 0.16 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.321 -179.904 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.546 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -75.83 -101.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.964 179.987 . . . . . . . . 3 3 . 1 . 062 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -133.59 13.84 4.08 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.068 179.94 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.459 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 6.3 ptm85 -58.77 -47.71 83.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.101 0.476 . . . . 0.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.459 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 1.3 mm -129.52 -20.58 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 179.033 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.25 -33.85 71.87 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.846 -0.901 . . . . 0.0 110.846 179.012 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -52.63 -14.2 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.051 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -105.72 -46.81 1.16 Allowed Glycine 0 C--N 1.336 0.582 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.442 -179.821 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.479 ' O ' ' N ' ' A' ' 19' ' ' GLY . 4.4 p -98.98 -37.59 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 116.974 0.387 . . . . 0.0 110.815 -179.428 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' GLY . 50.6 tttp -71.13 -31.62 67.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.435 179.928 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.22 -27.21 35.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.689 -179.939 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.451 HG23 ' N ' ' A' ' 19' ' ' GLY . 14.8 tt -163.54 -41.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.01 -179.883 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 47.99 64.08 3.21 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.032 -179.805 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -169.11 -70.72 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 179.802 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.78 -41.52 70.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.488 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -82.68 -33.38 27.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.123 179.578 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.6 tp -77.09 33.6 0.15 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.328 179.88 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.441 ' H ' ' C ' ' A' ' 22' ' ' ALA . 26.4 t0 -171.5 -25.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.501 -179.922 . . . . . . . . 2 2 . 1 . 062 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.7 t60 52.84 82.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 -179.991 . . . . . . . . 1 1 . 1 . 062 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.3 tp . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.188 -179.904 . . . . . . . . 0 0 . 1 . 063 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 111.969 -0.452 . . . . 0.0 111.969 . . . . . . . . . 0 0 . 1 . 063 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 54.13 29.56 10.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.87 0.367 . . . . 0.0 110.541 179.96 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -63.63 -43.72 96.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.505 179.974 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -164.13 78.67 0.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.249 -179.928 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 52.01 -178.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.275 -179.807 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -84.56 87.45 7.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.38 179.943 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.415 ' H ' ' H ' ' A' ' 8' ' ' LEU . 38.9 t90 -162.1 -4.01 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.873 -179.895 . . . . . . . . 2 2 . 1 . 063 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.574 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -63.94 -90.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.812 . . . . . . . . 3 3 . 1 . 063 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -171.75 27.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.33 -179.908 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.16 -89.82 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.588 . . . . . . . . 2 2 . 1 . 063 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.8 mm -81.84 -20.45 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.404 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.09 -38.99 62.22 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 179.414 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.6 ttpp -45.64 -31.59 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.256 0.551 . . . . 0.0 109.81 178.685 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -86.18 -41.5 7.02 Favored Glycine 0 N--CA 1.45 -0.401 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.503 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.54 -75.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 120.424 0.154 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.494 ' O ' ' N ' ' A' ' 18' ' ' ILE . 48.9 tttp -33.94 -38.63 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.931 . . . . . . . . 2 2 . 1 . 063 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.1 tt -45.42 -13.57 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.573 -179.491 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' LYS . 18.3 tt -161.54 -32.03 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.127 179.983 . . . . . . . . 2 2 . 1 . 063 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.51 56.79 18.18 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.014 -0.612 . . . . 0.0 111.945 -179.937 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.06 -67.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.189 -0.529 . . . . 0.0 111.951 -179.982 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.63 -48.29 49.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 0.0 110.413 179.921 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.75 -38.27 23.49 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.249 179.674 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 tp -75.68 68.37 2.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.417 -179.958 . . . . . . . . 1 1 . 1 . 063 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.482 ' OD1' ' ND1' ' A' ' 25' ' ' HIS . 29.1 p-10 -167.84 -20.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.526 179.959 . . . . . . . . 2 2 . 1 . 063 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.482 ' ND1' ' OD1' ' A' ' 24' ' ' ASP . 0.9 OUTLIER -73.18 114.45 11.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.473 179.977 . . . . . . . . 3 3 . 1 . 063 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.492 -179.998 . . . . . . . . 0 0 . 1 . 064 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 064 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -57.68 103.01 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.817 0.341 . . . . 0.0 110.519 -179.974 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 tpt85 -74.1 -36.56 64.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.816 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -145.51 53.35 1.18 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.496 -179.905 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 50.2 -96.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.615 179.968 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 46.0 mttp -145.48 70.62 1.26 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.262 -179.895 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 96.4 m95 -158.86 10.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.335 -179.919 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.568 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.44 -75.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.283 -179.714 . . . . . . . . 3 3 . 1 . 064 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -159.69 17.72 0.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.86 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HE ' ' HA ' ' A' ' 7' ' ' TRP . 6.6 ptt180 -45.9 -88.12 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.414 179.903 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.7 tt -88.68 -17.77 8.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.407 179.92 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.39 -41.58 55.52 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.992 -0.623 . . . . 0.0 111.732 179.78 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -47.38 -17.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.093 0.473 . . . . 0.0 110.256 179.244 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.33 -43.14 2.6 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.387 -179.895 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.6 m -106.08 -41.7 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 116.872 0.336 . . . . 0.0 111.061 -179.531 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.5 tttm -63.9 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.707 0.289 . . . . 0.0 110.728 -179.937 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.4 tt -45.78 -22.88 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.091 -179.795 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.551 HG23 ' N ' ' A' ' 19' ' ' GLY . 10.3 tp -158.76 -46.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.551 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 155.02 6.11 0.09 OUTLIER Glycine 0 C--N 1.333 0.41 0 N-CA-C 111.878 -0.489 . . . . 0.0 111.878 179.975 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.26 -13.1 11.01 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 121.28 -0.486 . . . . 0.0 112.022 -179.851 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.49 -66.52 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.813 0.34 . . . . 0.0 110.306 179.877 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.62 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.325 179.794 . . . . . . . . 1 1 . 1 . 064 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.505 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.4 mm? -77.08 -173.17 2.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.001 179.95 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 2.9 m-20 55.96 7.72 0.31 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 -179.912 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 23' ' ' LEU . 55.3 t-80 -102.47 98.89 8.91 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.436 179.997 . . . . . . . . 2 2 . 1 . 064 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.502 179.942 . . . . . . . . 0 0 . 1 . 065 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.959 -0.456 . . . . 0.0 111.959 . . . . . . . . . 0 0 . 1 . 065 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -55.89 150.84 12.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.814 0.34 . . . . 0.0 110.457 179.955 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -165.12 -24.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.683 179.988 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -147.62 20.71 1.17 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.48 -179.99 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 53.87 73.95 0.35 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.505 179.766 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt 48.46 78.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.731 179.817 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 33.5 t-105 -168.72 5.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.667 -179.776 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.871 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -51.89 -74.36 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.684 . . . . . . . . 3 3 . 1 . 065 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.408 ' O ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -171.6 11.96 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.198 179.197 . . . . . . . . 3 3 . 1 . 065 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' O ' ' O ' ' A' ' 9' ' ' ARG . 0.5 OUTLIER -41.7 -88.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.634 . . . . . . . . 3 3 . 1 . 065 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.34 -10.85 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.724 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.45 -44.27 95.42 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 179.507 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -46.59 -17.52 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.113 0.482 . . . . 0.0 109.879 178.654 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.78 -45.37 2.69 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.113 179.819 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.6 m -105.03 -43.04 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-N 116.938 0.369 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.0 tttt -51.84 -44.84 63.77 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.601 -179.81 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.565 HG23 ' H ' ' A' ' 18' ' ' ILE . 11.1 tt -50.29 -55.85 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.637 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.594 ' O ' HG23 ' A' ' 18' ' ' ILE . 9.7 tt -172.67 110.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 121.148 0.499 . . . . 0.0 110.097 178.715 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 161.6 -44.47 0.38 Allowed Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.906 -179.505 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.41 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -171.89 -148.55 6.2 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.089 -179.944 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.48 12.28 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.844 0.354 . . . . 0.0 110.408 179.994 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -167.16 -48.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.349 179.907 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.9 mt -83.07 38.0 0.57 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.524 179.891 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -166.59 -15.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.961 -179.917 . . . . . . . . 1 1 . 1 . 065 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.35 83.91 3.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.738 0.304 . . . . 0.0 110.572 -179.839 . . . . . . . . 2 2 . 1 . 065 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.8 mt . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.556 179.856 . . . . . . . . 0 0 . 1 . 066 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 066 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -56.4 -168.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.77 0.319 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -52.16 -80.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.341 179.969 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -86.73 23.64 1.64 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.455 179.921 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 54.17 -163.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.318 -179.749 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -72.7 79.53 1.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.874 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.63 ' H ' HD23 ' A' ' 8' ' ' LEU . 14.2 t-105 -160.68 -51.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.695 -179.846 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.63 HD23 ' H ' ' A' ' 7' ' ' TRP . 0.3 OUTLIER 19.44 -102.26 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 O-C-N 123.843 0.714 . . . . 0.0 112.607 -179.775 . . . . . . . . 3 3 . 1 . 066 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.486 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 15.5 mmt-85 -141.33 20.49 2.23 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.228 -179.81 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -46.56 -89.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.318 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 tp -73.03 -19.17 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.725 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.02 -45.02 88.01 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.143 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -47.1 -16.45 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.0 109.909 178.681 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.61 -38.77 4.61 Favored Glycine 0 C--N 1.334 0.429 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.244 179.949 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.1 m -110.96 -44.6 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.914 0.357 . . . . 0.0 111.189 -179.597 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' N ' ' O ' ' A' ' 12' ' ' GLY . 24.8 mmtp -56.67 -34.4 67.33 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.925 179.931 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.16 1.48 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.098 179.673 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.9 mt 62.64 96.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.295 -179.804 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.11 -53.26 0.04 OUTLIER Glycine 0 C--N 1.334 0.458 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 -179.882 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -176.03 -139.6 3.2 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.065 -179.968 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 56.03 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.674 0.273 . . . . 0.0 110.83 -179.96 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -71.77 -38.93 70.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.751 -179.982 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.8 38.27 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.472 -179.876 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 22' ' ' ALA . 28.5 t70 -170.45 -37.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.605 -179.992 . . . . . . . . 2 2 . 1 . 066 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 54.51 105.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.545 179.914 . . . . . . . . 1 1 . 1 . 066 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.347 179.982 . . . . . . . . 0 0 . 1 . 067 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.265 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 067 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -58.74 -36.98 75.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt-85 52.18 -98.09 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.967 179.728 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 6' ' ' LYS . 49.9 mttp -94.05 37.05 1.1 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.008 -179.542 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 53.55 -86.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.494 179.871 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 4' ' ' LYS . 92.9 mttt -146.94 78.63 1.5 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.967 0.413 . . . . 0.0 110.119 179.926 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.455 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 92.7 m95 -158.47 -0.6 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.214 179.98 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.475 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -76.17 -8.03 56.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.018 179.792 . . . . . . . . 3 3 . 1 . 067 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 63.97 38.61 8.59 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.042 179.89 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.294 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mm -101.91 -13.58 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.293 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.08 -34.22 72.19 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 110.766 -0.933 . . . . 0.0 110.766 179.313 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -51.34 -19.07 1.16 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 109.547 178.807 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.25 -46.02 2.68 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.367 -179.672 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.48 -41.49 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 116.874 0.337 . . . . 0.0 111.434 -179.447 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.4 tttm -60.91 -33.55 73.31 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.581 -179.786 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.3 tt -62.18 -2.19 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.013 0.435 . . . . 0.0 110.119 179.522 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.458 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.2 mt 63.92 77.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.18 -179.565 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -172.52 34.32 0.13 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.21 -179.931 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -175.71 -175.63 43.28 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.08 179.886 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.55 12.21 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.058 0.456 . . . . 0.0 110.148 -179.726 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.443 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -172.7 -49.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 067 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.7 tp -83.82 59.84 5.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.17 179.578 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -162.92 -22.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 -179.852 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -72.19 -60.8 2.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.507 -179.993 . . . . . . . . 1 1 . 1 . 067 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.544 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.069 -179.965 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 068 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.402 ' H ' ' H ' ' A' ' 3' ' ' ARG . 37.9 ptt180 -166.77 -4.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.691 0.282 . . . . 0.0 110.605 179.935 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.402 ' H ' ' H ' ' A' ' 2' ' ' ARG . 77.0 mtp180 -50.87 -31.29 16.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.888 0.375 . . . . 0.0 110.288 179.799 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -146.41 159.68 43.07 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.7 179.694 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' N ' ' A' ' 7' ' ' TRP . 15.6 ptm180 -52.7 173.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.372 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 1.0 OUTLIER -56.42 83.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.832 0.349 . . . . 0.0 110.165 -179.741 . . . . . . . . 3 3 . 1 . 068 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' N ' ' O ' ' A' ' 5' ' ' ARG . 73.9 t90 -171.62 -10.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.745 179.965 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.485 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -40.56 -89.9 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.121 -179.925 . . . . . . . . 3 3 . 1 . 068 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.485 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 32.9 mmm-85 -140.55 13.49 2.34 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.918 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptm180 -40.97 -88.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.538 179.769 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 tp -83.04 -15.46 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.444 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.17 -48.29 84.09 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.49 -179.937 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -46.26 -16.12 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.143 -0.621 . . . . 0.0 110.404 179.391 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -95.96 -40.13 4.14 Favored Glycine 0 C--N 1.336 0.561 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.863 -179.964 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.419 HG23 ' N ' ' A' ' 16' ' ' LYS . 15.7 m -112.06 -43.65 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 120.803 0.335 . . . . 0.0 110.249 179.852 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.561 ' N ' ' O ' ' A' ' 12' ' ' GLY . 13.4 ttmm -65.51 -37.44 86.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.736 179.733 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 8.1 tt -42.1 -20.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.069 179.946 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.49 ' N ' ' O ' ' A' ' 16' ' ' LYS . 29.9 mt -129.42 -80.25 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.343 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 165.1 6.77 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 121.184 -0.532 . . . . 0.0 111.951 179.965 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.12 5.47 10.31 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.899 -179.959 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.58 8.46 2.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.332 . . . . 0.0 110.558 -179.99 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.6 -53.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.549 -179.94 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.0 tp -78.54 55.83 1.69 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.361 179.901 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 26' ' ' LEU . 43.7 t0 -164.83 6.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.343 179.997 . . . . . . . . 2 2 . 1 . 068 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -52.36 -11.29 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.489 -179.999 . . . . . . . . 1 1 . 1 . 068 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 069 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -170.3 39.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.799 0.333 . . . . 0.0 110.549 -179.997 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -73.53 -19.46 60.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 -179.971 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -147.83 64.47 1.12 Allowed 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.749 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 48.94 -158.2 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.596 -179.682 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 54.6 mttm -100.75 64.05 1.08 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.756 -179.904 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 4.7 m-90 -160.48 11.67 0.11 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.477 179.85 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.553 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.16 -64.12 0.86 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.965 0.412 . . . . 0.0 110.207 179.853 . . . . . . . . 3 3 . 1 . 069 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.6 tpp85 -170.56 19.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.864 179.827 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -42.54 -89.5 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.709 179.825 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.3 tp -81.46 -22.75 10.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.375 -179.743 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.28 -42.55 73.92 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.283 179.574 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -45.29 -21.06 0.07 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.085 0.469 . . . . 0.0 110.216 179.073 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.1 -41.08 4.4 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.641 -179.623 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.409 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.7 m -111.68 -42.22 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.98 0.39 . . . . 0.0 111.495 -179.302 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.3 tttm -57.83 -35.51 70.99 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.588 -179.6 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.3 tt -62.5 -3.49 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 110.174 179.754 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.422 ' H ' ' C ' ' A' ' 16' ' ' LYS . 9.0 mt 63.41 76.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.248 -179.696 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -72.18 -13.62 76.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.026 -179.913 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.66 -36.62 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.045 -179.924 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.423 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -51.57 -73.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.786 0.327 . . . . 0.0 110.497 179.93 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -30.02 65.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.486 -179.991 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -78.69 48.07 0.78 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.004 -179.987 . . . . . . . . 2 2 . 1 . 069 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -167.04 -27.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.552 179.969 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.9 t60 50.61 72.62 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.607 -179.95 . . . . . . . . 1 1 . 1 . 069 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.412 ' C ' HD23 ' A' ' 26' ' ' LEU . 1.8 tt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.175 -179.888 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.499 ' O ' ' N ' ' A' ' 4' ' ' LYS . 41.8 mtm-85 55.84 -80.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.642 0.258 . . . . 0.0 110.826 179.964 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' A' ' 1' ' ' GLY . 50.7 ttp180 56.91 -80.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.669 179.962 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 2' ' ' ARG . 0.1 OUTLIER -111.24 53.13 0.72 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.801 0.334 . . . . 0.0 110.129 179.886 . . . . . . . . 3 3 . 1 . 070 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.485 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 10.8 mpt_? 51.61 75.05 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.146 -179.875 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.3 mttm 54.47 -165.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.426 -179.857 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.467 ' C ' ' H ' ' A' ' 9' ' ' ARG . 4.0 m0 60.92 10.02 2.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.718 179.998 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 2' ' ' ARG . 3.3 pp -73.69 20.76 0.09 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.801 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 7' ' ' TRP . 35.8 mmm-85 60.84 43.35 12.07 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.922 179.652 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -57.71 -81.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.027 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.2 tp -97.25 -16.26 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.312 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.517 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.66 -35.3 62.04 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.187 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -50.2 -16.87 0.36 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.119 0.485 . . . . 0.0 110.345 179.292 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.1 -40.14 2.51 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.406 -179.628 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.483 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.3 m -108.49 -40.92 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 116.698 0.249 . . . . 0.0 111.233 -179.429 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 12' ' ' GLY . 33.0 ttmt -69.16 -30.98 69.31 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.6 tt -45.19 -22.3 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.052 -179.87 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.461 HG23 ' N ' ' A' ' 19' ' ' GLY . 17.1 tt -163.42 -40.57 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.793 179.801 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 68.45 65.05 2.8 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.031 -0.604 . . . . 0.0 111.784 -179.793 . . . . . . . . 2 2 . 1 . 070 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -175.74 -61.62 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.258 -0.496 . . . . 0.0 111.952 -179.993 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.21 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.347 179.837 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.15 -30.98 67.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.071 179.601 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.33 61.68 3.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.178 179.839 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -168.12 -11.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.205 -179.977 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -79.85 -54.09 6.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.55 179.982 . . . . . . . . 1 1 . 1 . 070 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.545 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.148 -179.93 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 071 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.454 ' CD ' ' H ' ' A' ' 2' ' ' ARG . 0.5 OUTLIER -56.38 92.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.999 . . . . . . . . 3 3 . 1 . 071 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -60.74 -38.57 85.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.537 -179.871 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -162.62 53.79 0.2 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 -179.844 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.508 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 9.9 mpt_? 45.81 -170.11 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.576 179.873 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 63.2 mmtt -76.42 64.84 2.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.296 179.696 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CZ3' ' NH2' ' A' ' 10' ' ' ARG . 98.9 m95 -157.2 9.18 0.19 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.37 -179.821 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.562 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.78 -68.87 0.14 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.894 179.935 . . . . . . . . 3 3 . 1 . 071 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -168.89 21.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.17 179.537 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.504 ' NH2' ' CZ3' ' A' ' 7' ' ' TRP . 8.1 ptt180 -44.3 -90.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.188 179.507 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -74.25 -20.91 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.473 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.97 -44.39 94.54 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.597 179.872 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.15 -13.26 0.3 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 109.795 179.299 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.439 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.65 -28.79 7.29 Favored Glycine 0 C--N 1.335 0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.372 -179.977 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.434 HG23 ' N ' ' A' ' 16' ' ' LYS . 23.0 m -127.5 -42.59 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.885 0.343 . . . . 0.0 111.166 -179.503 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 12' ' ' GLY . 15.1 tmtt? -53.71 -53.3 54.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 110.47 -179.912 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.9 tp -72.23 9.47 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.191 0.52 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 58.1 81.36 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.446 -179.965 . . . . . . . . 2 2 . 1 . 071 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.74 122.01 8.16 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.843 179.971 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -48.96 -50.32 27.4 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.183 -0.532 . . . . 0.0 111.991 -179.959 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.16 -42.24 50.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 110.646 -179.892 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.05 -35.83 64.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.476 179.947 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.8 tp -79.29 51.48 1.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.432 -179.997 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -167.38 -54.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.583 -179.97 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -79.63 88.96 5.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.564 179.946 . . . . . . . . 1 1 . 1 . 071 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.7 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.129 179.968 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 111.954 -0.459 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 072 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 4' ' ' LYS . 73.1 mtt85 -58.63 -69.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.562 -179.908 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 49.73 -91.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.344 -179.908 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.455 ' N ' ' O ' ' A' ' 2' ' ' ARG . 68.1 mmtt -103.07 138.19 40.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.632 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -71.02 74.82 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.858 0.361 . . . . 0.0 110.702 -179.834 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.494 ' O ' ' NE ' ' A' ' 10' ' ' ARG . 91.1 mttt 56.27 35.56 25.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.042 179.624 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -124.53 8.0 8.31 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 178.91 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.35 42.94 0.29 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.236 179.512 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.612 ' HE ' ' N ' ' A' ' 9' ' ' ARG . 4.8 mmp_? 60.68 37.99 18.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.874 179.55 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.494 ' NE ' ' O ' ' A' ' 6' ' ' LYS . 7.2 ptt85 -49.18 -82.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.18 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.5 tt -95.31 -14.02 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.364 179.319 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.69 -40.49 88.59 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.412 -0.899 . . . . 0.0 111.34 179.801 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -49.93 -16.47 0.28 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 109.616 178.85 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.86 -45.03 3.22 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.282 179.93 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.404 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.5 m -109.38 -42.68 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.959 0.38 . . . . 0.0 111.47 -179.497 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.5 tttt -49.28 -48.7 45.82 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.622 -179.573 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.8 tt -59.11 -32.17 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.037 179.707 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.583 ' O ' HG23 ' A' ' 18' ' ' ILE . 9.3 tt -171.38 113.15 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.172 0.511 . . . . 0.0 110.653 179.077 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -80.05 56.5 4.59 Favored Glycine 0 C--N 1.33 0.249 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -179.997 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.428 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -44.21 -19.68 0.14 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.415 -179.768 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.423 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -77.08 18.97 0.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.862 0.363 . . . . 0.0 110.608 179.983 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.29 -39.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.322 179.937 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.516 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.3 mm? -78.89 56.52 1.95 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.808 179.846 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -163.29 -39.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.494 -179.761 . . . . . . . . 1 1 . 1 . 072 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.83 71.17 1.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.674 -179.969 . . . . . . . . 2 2 . 1 . 072 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.441 HD12 ' C ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.495 179.956 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 . . . . . . . . . 0 0 . 1 . 073 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -161.77 54.01 0.25 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.805 0.336 . . . . 0.0 110.608 179.974 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -61.43 -26.99 68.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.765 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -164.27 63.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.638 179.99 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 25.3 ttt85 59.88 -125.7 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.102 179.899 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.566 ' NZ ' ' NH2' ' A' ' 10' ' ' ARG . 62.2 mttm -122.3 86.29 2.56 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.82 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.487 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 93.1 m95 -158.74 -3.89 0.08 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.563 -179.765 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.574 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -67.63 -89.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 179.801 . . . . . . . . 3 3 . 1 . 073 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -173.89 18.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.324 -179.98 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.566 ' NH2' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 ptp180 -46.92 -88.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.735 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.0 tt -85.57 -12.63 11.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.792 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.66 -41.51 74.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.65 179.775 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -47.76 -16.7 0.08 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.018 0.437 . . . . 0.0 110.139 179.121 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.461 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.07 -44.26 2.26 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.399 179.943 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.2 m -103.57 -41.53 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.976 0.388 . . . . 0.0 110.9 -179.647 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 83.1 tttt -59.32 -35.46 73.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.689 0.28 . . . . 0.0 110.528 179.912 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.6 tt -68.49 4.56 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.069 0.462 . . . . 0.0 110.017 179.799 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.452 ' H ' ' C ' ' A' ' 16' ' ' LYS . 18.3 mt 61.89 61.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.383 -179.914 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.48 74.36 2.1 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.979 179.96 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 72.57 89.73 0.13 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.101 179.806 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.67 12.34 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.425 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . 57.57 43.45 22.57 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.71 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.46 20.44 8.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -178.342 . . . . . . . . 2 2 . 1 . 073 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.1 t0 45.99 40.95 7.56 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.915 -179.237 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -68.22 -66.73 0.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.633 -179.963 . . . . . . . . 1 1 . 1 . 073 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.793 -179.806 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 111.935 -0.466 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 074 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.504 ' N ' ' CD ' ' A' ' 2' ' ' ARG . 9.3 mpt_? -78.94 58.79 2.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.762 0.315 . . . . 0.0 110.331 -179.999 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -68.93 -52.85 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.54 179.966 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 6' ' ' LYS . 12.5 mptt -79.95 19.55 0.69 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.316 -179.862 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 65.8 mtt-85 53.21 -86.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.3 mttm -142.84 53.44 1.39 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.167 179.984 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -151.08 8.62 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.652 179.824 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.668 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.8 pt? -48.49 -36.63 15.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.233 -179.723 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.554 HH22 ' CA ' ' A' ' 17' ' ' ILE . 6.7 mmt180 159.22 24.66 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.83 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -42.26 -91.33 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 179.772 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -92.27 -19.37 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.138 -179.9 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.11 -38.03 60.11 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.03 -0.605 . . . . 0.0 111.738 179.647 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -50.15 -16.59 0.32 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.041 0.448 . . . . 0.0 110.251 179.63 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.428 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.39 -39.69 2.96 Favored Glycine 0 C--N 1.333 0.399 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.422 -179.808 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.3 m -109.19 -43.19 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 116.78 0.29 . . . . 0.0 111.189 -179.5 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 87.1 tttt -58.41 -39.61 80.18 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.499 -179.854 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.554 ' CA ' HH22 ' A' ' 9' ' ' ARG . 15.4 tt -49.97 -28.02 4.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.504 179.911 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.689 ' O ' HG23 ' A' ' 18' ' ' ILE . 16.9 tt -170.15 63.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.4 0.619 . . . . 0.0 110.346 179.868 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -174.79 -31.31 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.967 -179.968 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.439 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -72.75 70.97 1.13 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 121.129 -0.557 . . . . 0.0 111.958 179.963 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 54.03 9.98 0.25 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.182 -179.926 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.439 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . 57.88 45.69 17.98 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -178.691 . . . . . . . . 2 2 . 1 . 074 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.1 mt 57.89 17.11 4.05 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -178.214 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 t70 49.5 48.45 21.31 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.685 -179.099 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -76.42 -59.14 2.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.807 -179.663 . . . . . . . . 1 1 . 1 . 074 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.1 mp . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.081 -179.931 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 . . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -76.24 19.81 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.684 0.278 . . . . 0.0 110.516 179.998 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 1' ' ' GLY . 78.1 ttt180 -56.29 -44.97 80.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.5 -179.977 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -157.57 69.1 0.54 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 0.0 110.666 -179.851 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.481 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 8.9 mpt_? 54.03 -103.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.297 179.864 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 85.2 mttt -146.31 81.41 1.58 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 -179.871 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 96.5 m95 -159.35 7.29 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.334 179.919 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.541 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.95 -68.96 0.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.126 -179.925 . . . . . . . . 3 3 . 1 . 075 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.8 tpp85 -165.65 18.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.256 179.918 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -45.36 -88.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.046 179.413 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.3 tt -80.48 -17.96 12.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.363 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.13 -45.79 62.87 Favored Glycine 0 N--CA 1.451 -0.309 0 N-CA-C 111.609 -0.597 . . . . 0.0 111.609 179.568 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.62 -15.66 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.159 0.504 . . . . 0.0 110.047 179.044 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -100.17 -40.61 3.0 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.474 -179.979 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -107.7 -41.34 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 117.129 0.464 . . . . 0.0 111.051 -179.517 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' A' ' 12' ' ' GLY . 20.6 tptp -51.24 -59.35 4.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.767 0.318 . . . . 0.0 110.321 179.85 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.4 tt -65.29 0.77 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 110.094 179.769 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.451 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.2 mt 63.87 107.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.415 -179.947 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.49 -87.75 0.07 OUTLIER Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.67 179.992 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.21 -33.33 45.43 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.778 179.844 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.55 -51.95 51.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.837 0.351 . . . . 0.0 110.429 179.867 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.46 -43.13 64.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.325 179.8 . . . . . . . . 1 1 . 1 . 075 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.528 ' N ' HD12 ' A' ' 23' ' ' LEU . 7.5 mp -81.73 63.16 5.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.084 179.894 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.423 ' H ' ' H ' ' A' ' 25' ' ' HIS . 33.2 t70 -170.32 -16.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.29 179.897 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.423 ' H ' ' H ' ' A' ' 24' ' ' ASP . 19.0 t60 -92.3 98.59 11.59 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.586 179.951 . . . . . . . . 2 2 . 1 . 075 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.4 mm? . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.048 179.936 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 076 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 4' ' ' LYS . 89.0 mtt180 -63.36 -68.41 0.34 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.35 . . . . 0.0 110.508 -179.99 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 58.12 -78.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.956 179.897 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 2' ' ' ARG . 74.0 mttt -85.62 24.41 1.22 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.74 0.305 . . . . 0.0 110.613 -179.797 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.4 mtm180 50.47 -121.15 1.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.194 -179.775 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -99.64 68.06 1.53 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.6 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -163.03 4.28 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.779 -179.709 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.534 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.52 -70.85 0.09 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.399 -179.93 . . . . . . . . 3 3 . 1 . 076 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.57 18.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.15 -179.9 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -41.92 -89.7 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.329 179.815 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.6 pt -80.25 -17.26 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 179.241 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.84 -41.64 94.2 Favored Glycine 0 CA--C 1.507 -0.44 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.61 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -48.8 -15.88 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.254 0.549 . . . . 0.0 109.683 178.46 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.468 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.25 -45.45 2.01 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.607 -179.895 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.9 p -102.18 -40.38 7.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 117.205 0.503 . . . . 0.0 110.971 -179.389 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 55.6 tttm -53.51 -62.68 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.823 0.344 . . . . 0.0 110.443 -179.983 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 tt -75.39 10.51 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.122 -179.93 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt 60.04 99.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.23 -179.851 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -74.08 115.59 4.97 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 121.291 -0.48 . . . . 0.0 112.177 -179.725 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -76.9 -8.56 86.7 Favored Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 179.793 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.44 13.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.878 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.48 -54.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.243 179.967 . . . . . . . . 2 2 . 1 . 076 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.6 mt -79.62 57.95 2.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.47 179.869 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -166.75 -2.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.703 -179.879 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -71.39 -42.89 67.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 076 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.0 mt . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.661 -179.965 . . . . . . . . 0 0 . 1 . 077 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 077 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -76.68 63.45 2.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.758 0.313 . . . . 0.0 110.656 179.987 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 65.5 mtp85 -80.37 -48.82 12.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.592 -179.977 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.418 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 39.4 mtpt -99.15 18.71 16.79 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.8 -179.916 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 54.15 84.13 0.07 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.844 179.711 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.488 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 2.9 mptp? 46.2 67.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.776 179.651 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -171.32 7.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.37 179.864 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.821 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.2 -70.82 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.635 -179.701 . . . . . . . . 3 3 . 1 . 077 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.35 16.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.927 -179.996 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -40.03 -89.59 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.382 179.914 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.8 tt -83.31 -16.6 11.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.238 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.96 -41.74 85.22 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.501 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -48.83 -15.2 0.08 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.037 0.446 . . . . 0.0 110.165 179.023 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.446 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.86 -40.69 2.1 Favored Glycine 0 C--N 1.337 0.632 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.724 -179.702 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -106.78 -37.92 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-N 117.055 0.428 . . . . 0.0 111.091 -179.469 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.5 tttt -62.56 -45.95 90.58 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.909 -179.772 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 tp -51.78 -31.37 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.297 -179.713 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.438 ' CG1' ' H ' ' A' ' 19' ' ' GLY . 3.2 pt -117.03 -108.77 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.086 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.438 ' H ' ' CG1' ' A' ' 18' ' ' ILE . . . -166.16 11.97 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 121.271 -0.49 . . . . 0.0 111.901 179.916 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.49 -13.57 2.84 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.017 -179.924 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -74.7 -54.38 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 -179.925 . . . . . . . . 2 2 . 1 . 077 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.98 -12.18 3.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.631 -179.988 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.3 tp -67.46 -27.49 67.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 -179.93 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -155.02 57.22 0.66 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.512 -179.964 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -54.84 137.56 44.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.543 -179.992 . . . . . . . . 1 1 . 1 . 077 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.545 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 179.981 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.406 ' O ' ' O ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.012 -0.435 . . . . 0.0 112.012 . . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.406 ' O ' ' O ' ' A' ' 1' ' ' GLY . 51.3 mtm180 59.79 146.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 0.0 110.728 -179.981 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 57.9 ttt-85 -167.37 -53.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.592 179.955 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.527 ' C ' ' H ' ' A' ' 6' ' ' LYS . 19.3 ptmt -166.04 33.1 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.543 179.993 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.422 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 11.4 mpt_? 59.1 -6.12 0.06 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.788 179.901 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.527 ' H ' ' C ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -144.43 164.01 32.1 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.9 0.381 . . . . 0.0 110.192 179.792 . . . . . . . . 3 3 . 1 . 078 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.4 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 72.5 t-105 56.36 6.67 0.28 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.069 179.62 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.548 ' CD1' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -69.49 -84.45 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.653 . . . . . . . . 3 3 . 1 . 078 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.548 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 18.6 mmt85 -136.0 16.5 3.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.965 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -44.34 -88.5 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.705 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 tp -81.9 -15.66 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.889 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.9 -38.55 85.08 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 179.387 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -51.75 -12.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.074 0.464 . . . . 0.0 110.073 179.212 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.91 -39.38 2.33 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.565 -179.778 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -108.07 -41.07 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 116.935 0.367 . . . . 0.0 110.892 -179.409 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.8 tptm -56.22 -54.1 49.26 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.164 -179.99 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 tt -76.02 14.64 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 109.836 179.767 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.436 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 60.58 111.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.426 -179.946 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.28 -105.68 0.19 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.189 -0.529 . . . . 0.0 111.819 -179.946 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.446 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -68.33 -153.02 0.45 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.064 -0.589 . . . . 0.0 111.785 179.931 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.08 15.09 0.16 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.946 0.403 . . . . 0.0 110.217 -179.703 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.446 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -164.38 -57.57 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.854 179.992 . . . . . . . . 2 2 . 1 . 078 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.9 mt -80.77 23.47 0.53 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.115 179.533 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -168.02 14.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.669 -179.832 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -61.87 -59.35 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.533 -179.944 . . . . . . . . 1 1 . 1 . 078 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.548 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.914 -179.843 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.009 -0.436 . . . . 0.0 112.009 . . . . . . . . . 0 0 . 1 . 079 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.7 ttt85 -170.1 -53.83 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.845 0.355 . . . . 0.0 110.45 -179.939 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -75.92 -29.53 58.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.546 -179.981 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -155.28 61.33 0.63 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.487 -179.751 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 43.89 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.082 179.912 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -84.16 69.23 10.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.198 179.895 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CE2' ' NH2' ' A' ' 9' ' ' ARG . 71.5 t-105 -146.19 -9.39 0.51 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.13 -179.803 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -70.94 14.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.431 -179.855 . . . . . . . . 3 3 . 1 . 079 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.51 ' NH2' ' CE2' ' A' ' 7' ' ' TRP . 44.1 mmt-85 64.62 43.03 4.49 Favored 'General case' 0 CA--C 1.521 -0.155 0 O-C-N 123.065 0.228 . . . . 0.0 111.271 179.508 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -53.77 -93.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.643 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.4 tp -78.36 -16.5 13.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.687 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -59.21 -40.0 95.24 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 120.525 -0.845 . . . . 0.0 110.99 179.274 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -52.36 -14.35 0.46 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.269 0.557 . . . . 0.0 109.866 179.119 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.89 -29.6 6.1 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.55 -179.686 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.3 m -124.61 -42.29 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.765 0.283 . . . . 0.0 111.168 -179.355 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.5 tttp -59.8 -50.79 72.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.844 -179.615 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.8 tp -75.28 16.73 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.178 0.513 . . . . 0.0 110.335 -179.886 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.438 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.7 mm 58.04 87.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.357 179.923 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.53 70.36 1.94 Allowed Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.817 -0.513 . . . . 0.0 111.817 179.918 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.7 -35.46 2.11 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.252 -179.863 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.29 -49.8 60.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.758 0.314 . . . . 0.0 110.612 -180.0 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -79.91 -43.17 22.67 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.954 -179.656 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.8 mt -74.73 25.53 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.136 -179.626 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 22' ' ' ALA . 46.9 t0 -171.32 -6.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 0.0 110.295 179.561 . . . . . . . . 2 2 . 1 . 079 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 15.2 m80 54.71 75.68 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.489 -179.908 . . . . . . . . 1 1 . 1 . 079 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.3 tp . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.314 -179.974 . . . . . . . . 0 0 . 1 . 080 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 111.93 -0.468 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 080 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -71.94 72.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.22 179.869 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.3 ttm-85 -67.45 -41.35 84.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.4 ptmm? -161.02 49.82 0.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.475 -179.783 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 mtt85 55.71 -163.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.324 179.997 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 84.5 mttt -74.21 79.44 1.79 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.056 -179.402 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.482 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 91.6 m95 -160.34 1.67 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.152 179.656 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -51.21 -86.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.652 . . . . . . . . 3 3 . 1 . 080 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.417 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 5.7 tpp85 -160.82 23.92 0.14 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.266 179.931 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 ptt85 -49.08 -89.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.842 179.442 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.2 mm -78.29 -19.9 13.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.32 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.92 -38.53 89.21 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.397 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -51.28 -17.18 0.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.658 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.04 -47.01 2.13 Favored Glycine 0 C--N 1.334 0.448 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.119 179.942 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -101.67 -42.81 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-N 116.918 0.359 . . . . 0.0 111.137 -179.701 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 19.7 tptm -61.83 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.17 179.945 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.2 tt -62.5 -0.87 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.913 0.387 . . . . 0.0 110.047 179.52 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.486 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.8 mt 64.54 75.18 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.305 -179.874 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.98 32.82 0.23 Allowed Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.642 -179.985 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.51 -41.16 0.02 OUTLIER Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 179.991 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.96 -66.38 0.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 110.282 179.742 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.72 -34.68 39.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.331 179.76 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.91 76.18 5.4 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.307 0.575 . . . . 0.0 109.738 179.98 . . . . . . . . 2 2 . 1 . 080 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -172.28 -31.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.009 -179.829 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -79.45 63.63 4.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.644 179.946 . . . . . . . . 1 1 . 1 . 080 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.3 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.458 179.96 . . . . . . . . 0 0 . 1 . 081 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.409 ' C ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.05 -0.42 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 081 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.494 ' C ' ' H ' ' A' ' 4' ' ' LYS . 47.1 ttp180 -50.49 -14.21 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.838 0.352 . . . . 0.0 110.517 179.974 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.409 ' N ' ' C ' ' A' ' 1' ' ' GLY . 89.9 mtm180 -75.85 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.359 179.501 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' O ' ' N ' ' A' ' 6' ' ' LYS . 3.7 tmtm? -169.39 -50.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.847 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -56.03 83.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.383 179.237 . . . . . . . . 1 1 . 1 . 081 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' LYS . 64.2 mmtt 59.39 69.24 0.73 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 -179.919 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.441 ' C ' ' H ' ' A' ' 9' ' ' ARG . 78.9 t90 -160.26 -16.76 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.649 179.532 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.748 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.0 pt? -70.46 9.95 0.54 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.441 ' H ' ' C ' ' A' ' 7' ' ' TRP . 10.3 mmm180 54.08 53.13 11.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 110.301 179.97 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.545 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 13.4 ptt85 -68.57 -60.15 2.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.64 -179.871 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.545 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 17.3 tt -112.07 -19.09 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.707 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.571 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.11 -46.23 70.78 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.841 179.649 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -50.27 -13.62 0.13 Allowed 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.94 -0.741 . . . . 0.0 109.924 179.236 . . . . . . . . 1 1 . 1 . 081 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.76 -44.28 3.17 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.488 179.847 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.486 ' O ' ' N ' ' A' ' 19' ' ' GLY . 15.7 m -108.35 -43.37 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.831 0.348 . . . . 0.0 110.347 179.706 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.571 ' N ' ' O ' ' A' ' 12' ' ' GLY . 33.4 ttmt -64.88 -41.26 95.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 179.931 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.5 tp -38.69 -36.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.62 -179.617 . . . . . . . . 1 1 . 1 . 081 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 18' ' ' ILE . 12.0 tt -163.46 39.77 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 121.422 0.63 . . . . 0.0 110.687 -179.587 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -150.6 7.28 0.69 Allowed Glycine 0 C--N 1.331 0.281 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.479 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.408 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -152.2 -27.0 0.04 OUTLIER Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 179.783 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.22 16.23 0.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.93 0.395 . . . . 0.0 110.181 179.643 . . . . . . . . 1 1 . 1 . 081 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.408 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -158.92 -38.57 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.984 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.527 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.1 mp -78.87 56.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.849 179.736 . . . . . . . . 2 2 . 1 . 081 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -166.23 -48.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.527 -179.937 . . . . . . . . 1 1 . 1 . 081 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 53.9 61.37 3.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 -179.942 . . . . . . . . 1 1 . 1 . 081 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.3 mm? . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.139 179.986 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.221 0 N-CA-C 111.953 -0.459 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 082 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -171.01 27.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.352 . . . . 0.0 110.442 -179.973 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -62.24 -14.43 38.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.594 -179.889 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -159.79 77.52 0.67 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.73 -179.966 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 47.74 -106.87 0.17 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 179.633 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -149.18 81.59 1.42 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.829 0.347 . . . . 0.0 110.246 -179.876 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.467 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 73.8 t-105 -171.17 7.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.164 -179.934 . . . . . . . . 2 2 . 1 . 082 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.569 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.65 -69.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.106 -179.883 . . . . . . . . 3 3 . 1 . 082 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -160.36 20.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.006 -179.959 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -44.81 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.915 179.493 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.1 pt -80.51 -19.17 11.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.143 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.43 -39.37 73.15 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 179.328 . . . . . . . . 2 2 . 1 . 082 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -46.52 -19.35 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.192 0.52 . . . . 0.0 109.909 178.642 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.04 -46.27 2.67 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.215 -179.919 . . . . . . . . 2 2 . 1 . 082 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 m -100.47 -44.57 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 117.033 0.417 . . . . 0.0 111.466 -179.501 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' A' ' 12' ' ' GLY . 23.6 mmtp -59.7 -32.66 70.72 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.111 -179.868 . . . . . . . . 2 2 . 1 . 082 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.14 -1.83 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.077 0.465 . . . . 0.0 109.863 179.496 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.456 ' H ' ' C ' ' A' ' 16' ' ' LYS . 10.6 mt 64.01 85.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.291 -179.613 . . . . . . . . 2 2 . 1 . 082 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.02 -124.01 2.44 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 179.988 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.41 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -56.34 -162.84 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.077 -0.583 . . . . 0.0 111.931 -179.964 . . . . . . . . 2 2 . 1 . 082 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.33 14.14 0.35 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.953 0.406 . . . . 0.0 110.339 -179.89 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -168.49 -51.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.079 179.983 . . . . . . . . 2 2 . 1 . 082 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.4 tp -80.69 63.01 4.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.222 179.787 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -160.91 -25.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.518 -179.822 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -77.59 -53.99 6.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.666 179.929 . . . . . . . . 1 1 . 1 . 082 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.525 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.6 mp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.118 -179.915 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 N-CA-C 111.969 -0.453 . . . . 0.0 111.969 . . . . . . . . . 0 0 . 1 . 083 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -167.01 105.95 0.58 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.829 0.347 . . . . 0.0 110.535 -179.98 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -135.2 -17.34 1.83 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 179.978 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -163.88 59.2 0.16 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.086 179.769 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' TRP . 46.6 ttt85 59.64 151.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.249 -179.711 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -53.44 84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.55 -179.934 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.513 ' N ' ' O ' ' A' ' 5' ' ' ARG . 75.7 t-105 -171.87 10.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.408 -179.812 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.551 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.29 -68.42 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.169 -179.903 . . . . . . . . 3 3 . 1 . 083 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -166.15 18.76 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.157 179.937 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -43.84 -89.08 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.344 179.748 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.4 tp -80.5 -19.75 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.635 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.81 -41.92 84.56 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.606 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -49.89 -18.11 0.47 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.493 0.664 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -93.32 -40.83 4.69 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.853 -179.805 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.6 p -113.12 -40.78 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 117.272 0.536 . . . . 0.0 111.247 -179.184 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.4 tptt -51.14 -57.26 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.374 179.967 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.4 tt -71.5 -2.14 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.211 0.529 . . . . 0.0 109.624 179.442 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.9 mt 61.86 80.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.462 179.853 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.95 80.86 1.56 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.02 179.959 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -53.79 -11.29 1.97 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.814 179.915 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.55 16.41 0.37 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.73 0.3 . . . . 0.0 110.55 179.894 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -161.47 -42.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.4 -179.955 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.534 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.2 mp -79.87 58.97 3.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 083 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -162.08 -55.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.961 179.992 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -95.94 77.49 3.17 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.542 179.854 . . . . . . . . 1 1 . 1 . 083 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.3 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.179 179.956 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 . . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 65.79 -3.07 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.885 0.374 . . . . 0.0 110.391 179.984 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 1' ' ' GLY . 38.3 ttm180 -69.2 -19.34 63.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.381 179.811 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -135.47 37.74 2.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.441 -179.925 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 54.27 -163.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.681 179.77 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' N ' ' CD ' ' A' ' 6' ' ' LYS . 0.9 OUTLIER -64.14 98.34 0.22 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.186 179.974 . . . . . . . . 3 3 . 1 . 084 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.541 ' H ' HD23 ' A' ' 8' ' ' LEU . 77.0 t-105 -166.29 -83.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.248 179.727 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.541 HD23 ' H ' ' A' ' 7' ' ' TRP . 0.3 OUTLIER 24.43 -103.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 112.465 179.394 . . . . . . . . 3 3 . 1 . 084 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.461 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 6.3 tpp85 -168.96 31.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.006 -179.769 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -53.16 -89.61 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.359 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.0 tt -84.09 -14.79 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.187 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.51 -46.46 58.49 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.493 179.656 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -43.88 -18.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.999 0.428 . . . . 0.0 110.337 178.903 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -96.79 -43.36 3.12 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.391 -179.982 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.7 m -105.41 -42.8 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 117.034 0.417 . . . . 0.0 110.889 -179.653 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 7.1 tmtm? -56.56 -35.98 68.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 0.0 110.274 179.99 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.8 tt -65.39 1.92 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 121.006 0.431 . . . . 0.0 110.232 -179.975 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 63.14 89.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.446 180.0 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -169.97 11.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.883 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -169.99 -143.79 4.05 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 -179.995 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.3 -87.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.749 0.309 . . . . 0.0 110.369 179.932 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.502 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -77.25 -47.42 20.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.235 179.765 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.6 mt -79.81 70.08 6.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.473 179.872 . . . . . . . . 1 1 . 1 . 084 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.453 ' OD2' ' N ' ' A' ' 25' ' ' HIS . 58.4 p-10 -167.47 -14.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.387 -179.968 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.453 ' N ' ' OD2' ' A' ' 24' ' ' ASP . 12.8 t-80 -74.06 101.79 4.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 -179.943 . . . . . . . . 2 2 . 1 . 084 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.495 179.861 . . . . . . . . 0 0 . 1 . 085 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 085 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -169.61 59.2 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.319 179.998 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 57.8 mtp180 -50.26 -39.61 45.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.811 -179.853 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 61.3 tttp -156.44 64.67 0.54 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.457 -179.796 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 78.0 mtt-85 42.61 -91.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.98 179.909 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' LYS . 66.8 mmtt -123.18 -178.32 3.94 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.935 179.698 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.9 t90 58.38 3.47 0.27 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 179.861 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' CD1' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -56.54 -83.68 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.697 . . . . . . . . 3 3 . 1 . 085 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.509 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 15.1 mmm180 -140.08 19.6 2.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.994 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -47.23 -88.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.371 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 tt -82.46 -14.64 12.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.879 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.489 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.44 -39.86 84.82 Favored Glycine 0 C--N 1.334 0.428 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 179.494 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -50.88 -13.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.173 0.511 . . . . 0.0 109.934 178.913 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.99 -42.06 2.16 Favored Glycine 0 C--N 1.335 0.506 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.54 -179.866 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.432 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.5 m -105.6 -40.23 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 116.927 0.363 . . . . 0.0 111.169 -179.454 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.489 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.0 tttp -69.67 -28.3 65.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.731 0.3 . . . . 0.0 111.049 -179.723 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.8 tt -50.11 -20.85 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.969 -179.578 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.533 HG23 ' N ' ' A' ' 19' ' ' GLY . 6.5 tp -155.01 -46.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.563 179.829 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.533 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 164.75 -28.54 0.21 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 121.064 -0.589 . . . . 0.0 112.103 -179.972 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.32 -51.5 4.18 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.055 -179.92 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.04 -47.68 61.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.751 0.31 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.1 -36.8 61.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.51 -179.972 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.52 53.59 1.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 -179.943 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -163.4 -60.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.489 -179.931 . . . . . . . . 1 1 . 1 . 085 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 51.52 59.51 4.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.528 179.97 . . . . . . . . 2 2 . 1 . 085 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.022 -179.954 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 086 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.407 ' C ' ' H ' ' A' ' 4' ' ' LYS . 39.9 ttm180 -169.48 -27.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.788 0.328 . . . . 0.0 110.538 -179.988 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -76.41 40.04 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.631 179.987 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' H ' ' C ' ' A' ' 2' ' ' ARG . 17.2 tptp -168.63 -21.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.491 179.973 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -59.61 -64.29 1.0 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.424 179.892 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.492 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 78.7 mttt -145.53 59.42 1.27 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.094 -180.0 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 97.5 m95 -159.89 2.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.02 -179.887 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -49.38 -85.07 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.174 -179.919 . . . . . . . . 3 3 . 1 . 086 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.88 18.47 0.19 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.902 179.784 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -44.66 -89.38 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.394 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 tp -77.39 -19.33 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.14 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.85 -38.93 90.61 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 179.548 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -48.34 -17.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.113 0.483 . . . . 0.0 110.042 179.084 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.24 -43.36 2.58 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.36 -179.834 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.7 m -105.12 -42.45 7.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 116.845 0.323 . . . . 0.0 110.999 -179.517 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . 81.4 tttt -59.8 -40.35 88.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 0.0 110.43 -179.922 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.515 HG23 ' N ' ' A' ' 18' ' ' ILE . 17.1 tt -50.19 -43.32 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.555 -179.943 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.515 ' N ' HG23 ' A' ' 17' ' ' ILE . 13.7 mt -69.53 -65.04 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.107 179.74 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 173.64 52.26 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 179.884 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.77 -50.04 4.24 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.715 -0.554 . . . . 0.0 111.715 -179.753 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.98 31.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.705 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 61.14 40.55 14.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -177.403 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.518 ' N ' HD12 ' A' ' 23' ' ' LEU . 8.4 mp 56.58 21.36 5.66 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.222 . . . . . . . . 2 2 . 1 . 086 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p30 42.73 37.52 1.07 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.972 -179.097 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.31 137.28 18.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.249 -1.341 . . . . 0.0 110.664 179.852 . . . . . . . . 1 1 . 1 . 086 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.453 179.99 . . . . . . . . 0 0 . 1 . 087 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 . . . . . . . . . 0 0 . 1 . 087 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -64.53 -3.26 2.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.808 0.337 . . . . 0.0 110.511 -179.994 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -58.93 -37.82 77.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.555 179.97 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -129.08 138.16 51.69 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.256 179.999 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -49.27 -72.49 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.65 -179.91 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -145.94 77.3 1.49 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.334 -179.98 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.457 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 58.1 t-105 -161.55 -8.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.293 -179.96 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.9 pt? -57.12 -159.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 179.924 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.17 30.03 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.123 0.487 . . . . 0.0 110.125 -179.867 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.409 ' H ' ' C ' ' A' ' 8' ' ' LEU . 10.7 ptt85 -38.53 -37.4 0.31 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.473 179.305 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.7 tt -137.24 -16.81 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.949 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -58.66 -27.82 61.92 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.818 179.059 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -54.45 -22.9 13.95 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.64 -46.97 3.58 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.957 -0.857 . . . . 0.0 110.957 179.26 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 46.7 t -92.6 -72.75 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.618 0.247 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.1 ttmt -35.79 -35.75 0.07 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.333 -179.252 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.4 tt -45.56 -14.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.731 0.3 . . . . 0.0 111.463 -179.581 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.495 ' N ' ' O ' ' A' ' 16' ' ' LYS . 17.9 tt -155.54 -26.85 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.547 179.783 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.02 4.08 33.47 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 179.78 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.438 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -161.61 -36.71 0.02 OUTLIER Glycine 0 C--N 1.33 0.238 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 179.947 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.71 8.08 1.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.95 0.405 . . . . 0.0 110.076 179.594 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.438 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -159.25 -39.92 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.157 -179.943 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -78.91 27.94 0.22 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.077 179.805 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 22' ' ' ALA . 22.7 t70 -165.62 -26.63 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.342 -179.956 . . . . . . . . 2 2 . 1 . 087 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 58.79 105.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.684 179.838 . . . . . . . . 1 1 . 1 . 087 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.423 ' C ' HD23 ' A' ' 26' ' ' LEU . 1.5 tt . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.155 179.929 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.007 -0.437 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 088 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -79.09 60.78 3.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 110.604 179.967 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -54.89 -45.51 74.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' O ' ' N ' ' A' ' 6' ' ' LYS . 18.4 pttm -156.72 62.09 0.53 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.469 -179.924 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 60.4 -76.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.978 179.858 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 4' ' ' LYS . 81.8 mttt -142.45 -170.15 3.13 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.754 0.311 . . . . 0.0 110.463 -179.857 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.592 ' CE2' ' NH2' ' A' ' 9' ' ' ARG . 2.0 t90 69.2 -0.12 2.62 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.249 179.396 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 8' ' ' LEU . 0.8 OUTLIER -71.26 12.93 0.26 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.436 -179.727 . . . . . . . . 3 3 . 1 . 088 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.592 ' NH2' ' CE2' ' A' ' 7' ' ' TRP . 4.3 mmt-85 61.41 45.48 8.47 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.136 179.854 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -51.04 -86.83 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.699 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.5 pp -92.5 -7.73 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.383 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -62.59 -37.06 94.12 Favored Glycine 0 C--N 1.336 0.582 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.382 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.417 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 5.2 ttpm? -49.33 -15.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.959 0.409 . . . . 0.0 109.916 178.793 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.452 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.4 -42.39 2.2 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.571 -179.651 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -105.62 -40.36 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 116.823 0.311 . . . . 0.0 110.893 -179.529 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.9 tptt -67.93 -32.53 73.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.657 -179.911 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.53 HG23 ' H ' ' A' ' 18' ' ' ILE . 2.5 tp -47.02 -55.47 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.521 -179.811 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.53 ' H ' HG23 ' A' ' 17' ' ' ILE . 25.3 mt -89.31 -72.92 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.342 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -172.18 -14.78 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.077 -179.988 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.71 -34.22 1.01 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 121.207 -0.52 . . . . 0.0 112.009 -179.985 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -50.16 -44.56 52.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.87 0.367 . . . . 0.0 110.234 179.875 . . . . . . . . 2 2 . 1 . 088 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.06 -47.98 63.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.076 179.588 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.6 mt -79.83 39.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -165.77 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -179.951 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.0 m80 -76.49 84.44 3.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.536 -179.977 . . . . . . . . 1 1 . 1 . 088 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.492 179.817 . . . . . . . . 0 0 . 1 . 089 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 089 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.9 mtt-85 -64.63 80.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.803 0.335 . . . . 0.0 110.508 179.981 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.437 ' C ' ' H ' ' A' ' 5' ' ' ARG . 41.9 ttp180 -74.2 -61.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.637 -179.898 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 6' ' ' LYS . 86.2 mttt -78.25 30.96 0.18 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.621 -179.967 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.437 ' H ' ' C ' ' A' ' 3' ' ' ARG . 84.6 mtm180 54.15 -83.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.744 179.99 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 4' ' ' LYS . 88.5 mttt -141.82 74.28 1.45 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.474 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 73.5 t-105 -169.72 13.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.469 -179.954 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.551 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -73.58 -87.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.89 179.739 . . . . . . . . 3 3 . 1 . 089 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -168.27 25.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.355 179.94 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -47.5 -90.39 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.744 179.4 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.2 pt -85.46 -14.62 10.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.272 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -53.64 -44.87 68.99 Favored Glycine 0 C--N 1.331 0.287 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -45.39 -17.1 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.962 0.411 . . . . 0.0 110.327 178.925 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -101.97 -42.55 2.24 Favored Glycine 0 C--N 1.336 0.578 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.792 -179.725 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.7 m -104.2 -40.26 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 117.226 0.513 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 12' ' ' GLY . 53.1 tttp -56.53 -58.05 9.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.807 0.337 . . . . 0.0 110.658 -179.776 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.3 tt -77.41 20.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-O 121.173 0.511 . . . . 0.0 110.342 -179.675 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.415 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.5 mt 58.92 100.38 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.28 -179.976 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.07 -116.85 0.39 Allowed Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -179.963 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.569 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 53.18 175.13 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.804 -0.712 . . . . 0.0 111.829 179.644 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 22' ' ' ALA . . . -60.41 -1.7 0.39 Allowed 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.367 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.569 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . 100.52 79.35 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.758 -179.925 . . . . . . . . 2 2 . 1 . 089 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt 45.46 49.04 10.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.094 -179.157 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -159.13 3.29 0.09 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.311 -1.313 . . . . 0.0 107.774 -179.41 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -78.21 -70.77 0.46 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.948 -179.058 . . . . . . . . 1 1 . 1 . 089 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.1 -179.797 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 111.932 -0.467 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 090 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -167.36 52.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.763 0.316 . . . . 0.0 110.363 -179.965 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -66.43 -25.22 66.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.71 -179.96 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 6' ' ' LYS . 82.9 tttt -163.86 61.67 0.16 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.429 -179.672 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 40.41 -91.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.112 179.878 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 4' ' ' LYS . 43.3 mtmt -115.9 170.56 8.38 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.934 179.598 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.46 ' C ' ' H ' ' A' ' 9' ' ' ARG . 1.9 m0 61.45 9.78 2.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.948 179.786 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.635 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.8 pt? -72.62 22.68 0.06 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.394 -179.934 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 7' ' ' TRP . 0.8 OUTLIER 52.64 48.19 23.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.982 . . . . . . . . 3 3 . 1 . 090 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.5 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 8.4 ptm180 -57.91 -55.67 31.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.17 179.644 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.5 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 15.1 tt -119.97 -16.34 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.874 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.494 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.64 -34.36 60.44 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 178.938 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -49.66 -18.65 0.48 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.267 0.556 . . . . 0.0 109.814 178.989 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.434 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.91 -47.67 1.87 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.358 -179.731 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.29 -41.06 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 116.997 0.399 . . . . 0.0 111.366 -179.457 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 12' ' ' GLY . 8.6 tmtm? -61.08 -36.26 79.17 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.943 179.974 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.66 -2.14 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.044 0.45 . . . . 0.0 110.104 179.672 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 16' ' ' LYS . 10.0 mt 63.84 84.31 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.251 -179.78 . . . . . . . . 2 2 . 1 . 090 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -160.46 25.32 0.28 Allowed Glycine 0 C--N 1.331 0.256 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.784 179.996 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 -46.45 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.871 179.981 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.97 -63.91 0.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.815 0.341 . . . . 0.0 110.379 179.978 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.77 -40.29 91.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.347 179.933 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.3 mt -79.89 43.37 0.59 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -163.98 -32.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 -179.965 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.1 t60 54.84 105.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.589 -179.917 . . . . . . . . 1 1 . 1 . 090 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.403 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.358 -179.986 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 091 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 58.9 52.11 6.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.87 0.367 . . . . 0.0 110.293 -179.901 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -74.85 -24.08 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.578 -179.921 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 pttm -164.2 79.69 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.387 -179.88 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 54.71 -91.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.727 179.889 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -167.73 91.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.065 0.46 . . . . 0.0 110.596 -179.764 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.423 ' C ' ' H ' ' A' ' 9' ' ' ARG . 38.4 t90 -162.4 -4.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.152 179.708 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -69.81 8.79 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 179.986 . . . . . . . . 3 3 . 1 . 091 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.3 mmt85 62.91 45.54 5.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.076 179.688 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -51.14 -88.05 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.566 . . . . . . . . 3 3 . 1 . 091 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.4 pp -98.37 -3.43 9.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.142 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -62.93 -34.95 91.3 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 178.822 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -51.04 -21.47 1.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.061 -0.57 . . . . 0.0 109.767 178.733 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.28 -36.4 5.43 Favored Glycine 0 C--N 1.333 0.413 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.636 -179.508 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.6 m -115.7 -44.88 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.055 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.4 ttmt -53.65 -54.11 42.42 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.805 -179.381 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.9 tt -69.01 5.55 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 -179.84 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.452 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.5 mt 60.47 81.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.316 179.978 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.46 83.11 0.78 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.167 -0.539 . . . . 0.0 112.026 -179.973 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -54.98 -14.69 5.82 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.11 -0.566 . . . . 0.0 111.838 179.93 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.65 19.61 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 179.947 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.05 -46.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.316 -179.958 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.3 mt -80.2 57.59 2.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.458 179.861 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' C ' ' H ' ' A' ' 26' ' ' LEU . 26.0 t0 -167.67 2.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.557 179.996 . . . . . . . . 2 2 . 1 . 091 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -76.37 20.28 0.22 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.647 179.921 . . . . . . . . 1 1 . 1 . 091 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.491 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.5 mm? . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.058 -179.965 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 092 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -168.28 50.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.918 0.389 . . . . 0.0 110.249 -179.945 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.2 mtp-105 -78.63 -13.19 59.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.661 -179.89 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 39.8 mttm -145.3 50.24 1.23 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.527 -179.903 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 51.04 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.981 179.669 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 51.5 mtmt -141.79 71.97 1.37 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.418 -179.709 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.0 m-90 -159.89 10.25 0.11 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.522 179.885 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.793 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.32 -70.48 0.09 Allowed 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.93 . . . . . . . . 3 3 . 1 . 092 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.12 18.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.11 179.766 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptm85 -39.32 -90.21 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.438 179.761 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.578 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.8 pp -94.2 0.29 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.748 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.578 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -65.46 -41.66 96.24 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 179.217 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.401 ' O ' HD11 ' A' ' 17' ' ' ILE . 32.1 ttpt -47.06 -18.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.133 0.492 . . . . 0.0 110.215 179.155 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.46 -40.39 3.94 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.315 -179.957 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.6 m -111.1 -42.04 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.814 0.307 . . . . 0.0 111.745 -179.181 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.7 tttp -49.07 -61.77 1.89 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.188 -179.412 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.401 HD11 ' O ' ' A' ' 13' ' ' LYS . 23.9 pt -73.39 15.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.893 -179.765 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.442 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.7 mt 59.41 108.69 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.389 179.975 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.49 -94.33 0.1 OUTLIER Glycine 0 C--N 1.33 0.21 0 C-N-CA 121.289 -0.481 . . . . 0.0 111.91 -179.906 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.444 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -67.54 -161.46 1.57 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.012 -179.912 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 54.73 9.7 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 0.0 110.302 -179.704 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.444 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.33 -58.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.179 -179.955 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 mt -93.67 58.5 2.71 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.413 179.693 . . . . . . . . 1 1 . 1 . 092 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.443 ' H ' ' H ' ' A' ' 25' ' ' HIS . 18.9 t70 -166.42 0.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.549 -179.991 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.443 ' H ' ' H ' ' A' ' 24' ' ' ASP . 10.0 p80 -54.11 140.15 32.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.596 179.96 . . . . . . . . 2 2 . 1 . 092 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.591 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.8 mp . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.061 -179.998 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 . . . . . . . . . 0 0 . 1 . 093 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -75.19 -11.02 59.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.851 0.357 . . . . 0.0 110.58 -179.986 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.537 HH22 HH22 ' A' ' 9' ' ' ARG . 89.4 mtm180 53.65 -101.17 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 093 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -102.37 48.82 0.86 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.71 -179.763 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 91.9 mtm180 51.92 -98.22 0.07 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.795 179.686 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 93.6 mttt -141.08 80.87 1.76 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.064 -179.943 . . . . . . . . 2 2 . 1 . 093 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 89.2 m95 -159.45 -10.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.493 -179.829 . . . . . . . . 2 2 . 1 . 093 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.619 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -53.02 -92.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -180.0 . . . . . . . . 3 3 . 1 . 093 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.537 HH22 HH22 ' A' ' 3' ' ' ARG . 0.0 OUTLIER -171.61 22.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.866 179.835 . . . . . . . . 3 3 . 1 . 093 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -44.73 -89.81 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.77 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.1 tp -80.19 -17.18 12.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.947 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.535 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.92 -37.1 90.51 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 179.11 . . . . . . . . 2 2 . 1 . 093 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -50.64 -17.98 0.62 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.747 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.41 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.93 -43.65 3.51 Favored Glycine 0 C--N 1.334 0.461 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.268 -179.859 . . . . . . . . 2 2 . 1 . 093 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -107.11 -43.53 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 116.704 0.252 . . . . 0.0 110.994 -179.53 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' A' ' 12' ' ' GLY . 39.8 tptt -57.57 -33.32 68.04 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.374 -179.93 . . . . . . . . 2 2 . 1 . 093 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.8 tp -58.26 -6.58 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 109.724 179.614 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.456 ' H ' ' C ' ' A' ' 16' ' ' LYS . 7.0 mt 67.47 82.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.239 179.887 . . . . . . . . 2 2 . 1 . 093 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.85 -54.27 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.864 179.932 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -67.06 -38.11 92.29 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 121.289 -0.481 . . . . 0.0 111.973 -179.972 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 -48.83 67.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 110.595 -179.952 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.59 -17.26 63.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 -179.974 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 tp -64.14 -16.5 62.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.217 -179.965 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -158.6 61.26 0.43 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.405 -179.977 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -53.92 154.22 4.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 093 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.6 mp . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.094 179.976 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 094 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -166.26 128.73 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.877 0.37 . . . . 0.0 110.635 179.97 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' CD ' ' N ' ' A' ' 3' ' ' ARG . 11.2 mpt_? -92.72 -50.21 5.7 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.046 179.998 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -145.29 -10.64 0.55 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.242 -179.866 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 59.18 115.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.93 179.809 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 50.7 mtmt 46.53 43.1 11.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.343 179.457 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.641 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 m-90 -168.3 11.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.276 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.641 HD23 ' H ' ' A' ' 7' ' ' TRP . 0.2 OUTLIER -82.02 -10.58 59.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.796 179.928 . . . . . . . . 3 3 . 1 . 094 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 65.62 32.95 8.84 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.084 179.557 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -45.44 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.634 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.5 tt -87.0 -16.22 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.781 179.036 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.42 -37.45 66.28 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.045 -0.597 . . . . 0.0 111.697 179.689 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.31 -15.06 0.2 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.953 0.406 . . . . 0.0 110.064 179.389 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.437 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.42 -43.2 1.89 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.47 -179.912 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -104.8 -39.92 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.862 0.331 . . . . 0.0 111.042 -179.514 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' A' ' 12' ' ' GLY . 19.6 tptp -68.46 -31.86 71.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.434 179.962 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.4 tt -49.57 -24.81 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.677 -179.802 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.4 mm -138.5 -73.2 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.405 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -179.32 -20.37 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.197 -179.984 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.442 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 75.61 -20.88 2.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 121.164 -0.541 . . . . 0.0 111.944 179.997 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.418 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -65.57 1.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.935 0.397 . . . . 0.0 110.486 179.89 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.442 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -140.08 -48.32 0.45 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.092 179.902 . . . . . . . . 2 2 . 1 . 094 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.8 tp -77.06 64.2 2.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.183 179.765 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -166.9 -8.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 -179.856 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -70.65 -45.45 65.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.612 -179.847 . . . . . . . . 1 1 . 1 . 094 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.456 -179.994 . . . . . . . . 0 0 . 1 . 095 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 095 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.1 mmt180 -69.14 2.4 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.311 . . . . 0.0 110.529 179.94 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -56.32 -16.11 5.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.499 179.956 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -146.4 141.02 26.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 179.714 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -50.21 -66.9 0.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 -179.673 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -144.14 76.88 1.53 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.56 -179.703 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -171.24 7.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.306 179.783 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -65.23 -86.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.905 179.746 . . . . . . . . 3 3 . 1 . 095 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.63 12.52 0.53 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.924 0.392 . . . . 0.0 110.502 179.61 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.544 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 16.8 ptt85 -43.06 -60.12 1.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.096 179.846 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.544 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 1.2 mm -116.02 -16.25 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.353 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.509 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.24 -34.62 67.78 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.021 179.252 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -54.2 -12.48 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.966 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.437 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.21 -46.93 1.38 Allowed Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.995 -179.964 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.2 m -101.19 -39.03 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 116.716 0.258 . . . . 0.0 111.041 -179.624 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.0 tttt -69.71 -25.6 63.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.916 -179.778 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.7 tt -43.53 -23.57 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.774 0.321 . . . . 0.0 111.278 -179.939 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.521 HG23 ' N ' ' A' ' 19' ' ' GLY . 16.1 tt -156.17 -43.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.541 -179.976 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.521 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 166.85 -20.55 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.177 -0.535 . . . . 0.0 111.842 -179.935 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.17 -21.74 1.7 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.438 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -68.01 -46.95 69.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.821 0.343 . . . . 0.0 110.323 179.908 . . . . . . . . 2 2 . 1 . 095 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.89 -38.81 44.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.468 179.888 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 12.2 tp -76.04 70.14 2.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.416 -179.938 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 p30 -173.16 -10.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 -51.08 156.09 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.554 -179.891 . . . . . . . . 1 1 . 1 . 095 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.599 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.194 -179.964 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 096 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.5 mtt85 -56.18 120.59 7.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.771 0.319 . . . . 0.0 110.587 179.977 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -165.46 -39.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.393 179.923 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -120.66 45.15 2.3 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.836 179.89 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.7 tpp180 47.99 42.85 17.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.466 -179.778 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 50.95 81.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.474 -179.839 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.429 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 73.1 t-105 -166.13 14.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.739 -179.836 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -77.39 -93.59 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.214 179.824 . . . . . . . . 3 3 . 1 . 096 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.462 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 32.2 mmt-85 -141.41 14.67 2.19 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.811 -179.327 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 4.5 ptm180 -47.48 -87.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.822 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.402 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.2 tp -80.96 -14.36 12.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.04 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -49.33 -52.21 24.06 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.872 179.736 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 mtmm -44.18 -17.76 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.875 0.369 . . . . 0.0 110.678 179.474 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -98.71 -31.32 6.4 Favored Glycine 0 C--N 1.332 0.322 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.425 -179.816 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 12' ' ' GLY . 16.2 m -119.92 -44.02 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 116.967 0.384 . . . . 0.0 111.215 -179.595 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 12' ' ' GLY . 37.4 tptt -53.64 -57.76 9.63 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.428 -179.894 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 tp -74.81 14.04 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.361 -179.891 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.419 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.3 mt 56.68 81.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.377 -179.869 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -66.27 98.48 0.38 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.951 179.94 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -66.72 -12.07 58.65 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.075 -179.961 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.93 10.89 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 110.57 179.983 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.25 -45.74 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 -179.959 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.567 ' N ' HD12 ' A' ' 23' ' ' LEU . 7.2 mp -78.64 48.51 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.063 179.971 . . . . . . . . 2 2 . 1 . 096 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -165.1 -55.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.505 -179.963 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 14.3 t-80 54.34 77.36 0.2 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.511 -179.992 . . . . . . . . 1 1 . 1 . 096 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.389 179.834 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 N-CA-C 111.94 -0.464 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 097 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.9 mtm-85 -52.42 130.15 30.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.513 -179.892 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.41 -36.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.356 179.979 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -141.67 53.82 1.51 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.0 0.429 . . . . 0.0 110.005 179.834 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mmt180 48.42 29.31 1.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.605 -179.868 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.6 mttm 54.88 95.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.375 -179.776 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.424 ' C ' ' N ' ' A' ' 9' ' ' ARG . 58.1 t90 -164.81 -13.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.544 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.95 -12.17 0.54 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.991 . . . . . . . . 3 3 . 1 . 097 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' N ' ' C ' ' A' ' 7' ' ' TRP . 3.3 tpp85 76.08 31.31 0.67 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.356 -179.81 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.1 ptt85 -50.02 -90.73 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.35 -0.386 . . . . 0.0 109.963 179.512 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.8 tt -80.86 -21.83 11.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.214 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.91 -40.11 71.26 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.778 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -50.13 -15.11 0.19 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.189 0.519 . . . . 0.0 109.832 178.947 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . -100.0 -43.04 2.5 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.53 -179.773 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.3 m -104.35 -42.36 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 117.002 0.401 . . . . 0.0 111.324 -179.437 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 12' ' ' GLY . 1.1 tmtm? -52.92 -62.32 1.73 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.04 -179.863 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.7 tt -72.09 8.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.164 0.507 . . . . 0.0 109.791 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.454 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.1 mm 60.94 94.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.018 -179.849 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -65.33 138.87 39.06 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.092 -179.834 . . . . . . . . 2 2 . 1 . 097 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.25 -28.02 71.58 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.079 -0.581 . . . . 0.0 111.911 179.892 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.58 -55.86 19.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.856 0.36 . . . . 0.0 110.421 179.801 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.1 -46.16 65.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.381 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.1 tp -77.97 67.08 3.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.271 179.87 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -166.74 -8.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.382 179.985 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.79 -2.64 27.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.481 -179.975 . . . . . . . . 1 1 . 1 . 097 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.442 179.976 . . . . . . . . 0 0 . 1 . 098 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 098 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.0 mtm180 -149.74 -37.41 0.15 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.855 0.359 . . . . 0.0 110.212 179.918 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 51.15 -100.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 179.95 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -83.88 -78.25 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.748 -0.205 . . . . 0.0 110.628 -179.737 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 55.5 ttt180 -173.39 -56.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.745 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.41 ' C ' ' H ' ' A' ' 8' ' ' LEU . 70.0 mmtt -133.69 156.63 47.57 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.727 179.54 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.42 ' CD1' ' O ' ' A' ' 7' ' ' TRP . 59.7 t-105 60.76 3.2 0.59 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 179.616 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.52 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -46.04 -86.59 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.81 0.338 . . . . 0.0 110.259 179.558 . . . . . . . . 3 3 . 1 . 098 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.432 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 6.1 tpt180 -160.81 25.4 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.941 179.768 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -49.65 -89.24 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.87 179.613 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.2 pt -85.1 -14.09 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.308 179.579 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.4 -46.69 71.84 Favored Glycine 0 CA--C 1.508 -0.398 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -44.84 -20.06 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.124 0.488 . . . . 0.0 109.773 178.438 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -91.02 -45.53 4.14 Favored Glycine 0 C--N 1.333 0.417 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.294 179.908 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.439 HG23 ' N ' ' A' ' 16' ' ' LYS . 28.5 m -109.79 -42.46 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 117.112 0.456 . . . . 0.0 111.135 -179.696 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.523 ' N ' ' O ' ' A' ' 12' ' ' GLY . 80.7 tttt -59.05 -27.35 65.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.221 179.955 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.0 tt -64.46 -4.03 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.867 179.606 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.0 mm 63.21 66.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.206 -179.695 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -118.39 51.48 0.75 Allowed Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.707 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.449 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 65.32 8.08 35.81 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 -179.445 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.54 13.42 0.2 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.053 0.454 . . . . 0.0 110.159 -179.651 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.449 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -163.2 3.84 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.94 179.952 . . . . . . . . 2 2 . 1 . 098 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -122.86 55.86 1.17 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.552 179.649 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -138.44 -51.25 0.57 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.134 -179.658 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -77.24 101.16 6.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.547 179.901 . . . . . . . . 1 1 . 1 . 098 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.126 179.962 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.254 0 N-CA-C 111.902 -0.479 . . . . 0.0 111.902 . . . . . . . . . 0 0 . 1 . 099 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -68.54 85.34 0.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.839 0.352 . . . . 0.0 110.569 179.954 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -59.35 -41.26 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -145.51 47.85 1.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 -179.721 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.45 66.36 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.639 -179.93 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 62.1 mttm 56.38 -160.15 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 -179.898 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 96.0 m95 55.15 14.9 1.1 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.493 ' H ' HD12 ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.43 -70.73 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.831 0.348 . . . . 0.0 110.079 -179.986 . . . . . . . . 3 3 . 1 . 099 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -167.33 14.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.363 -179.896 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.3 ptt180 -42.72 -88.45 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.892 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.8 tt -87.22 -13.52 10.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 178.975 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.488 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.88 -36.91 75.23 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 110.786 -0.925 . . . . 0.0 110.786 179.462 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.24 -16.09 0.09 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.042 0.449 . . . . 0.0 110.077 178.781 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.48 -45.26 1.46 Allowed Glycine 0 C--N 1.336 0.537 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.493 -179.83 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.4 m -101.41 -39.2 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 117.014 0.407 . . . . 0.0 111.198 -179.55 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 12' ' ' GLY . 11.9 ttmm -70.72 -33.43 70.84 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.633 -179.857 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.7 tt -48.14 -26.57 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.832 0.348 . . . . 0.0 110.444 179.965 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.4 mt -135.39 -79.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.128 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.08 50.95 0.01 OUTLIER Glycine 0 C--N 1.332 0.324 0 N-CA-C 111.804 -0.519 . . . . 0.0 111.804 179.951 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.424 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 48.67 -137.08 17.38 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.195 -0.526 . . . . 0.0 111.834 -179.874 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.51 15.08 0.19 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.888 0.375 . . . . 0.0 110.426 179.99 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.424 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -171.64 -65.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.351 -179.932 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' N ' ' CD2' ' A' ' 23' ' ' LEU . 2.4 mm? -79.64 59.7 3.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.116 179.821 . . . . . . . . 2 2 . 1 . 099 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -165.9 -9.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.641 -179.964 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -68.73 163.99 22.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.98 . . . . . . . . 1 1 . 1 . 099 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.512 179.948 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 100 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 4' ' ' LYS . 70.3 mtm180 -60.61 -73.27 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.488 -179.991 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.0 ttt-85 60.33 -77.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.693 -179.948 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 6' ' ' LYS . 49.4 mttm -104.36 38.07 1.96 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.68 0.276 . . . . 0.0 110.528 179.928 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 53.51 -85.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.617 179.934 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' LYS . 54.4 mttm -145.71 58.29 1.24 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.207 -179.947 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.407 ' C ' ' H ' ' A' ' 9' ' ' ARG . 93.5 m95 -147.39 18.75 1.2 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.683 179.81 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.41 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -80.35 24.26 0.45 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.652 179.6 . . . . . . . . 3 3 . 1 . 100 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.407 ' H ' ' C ' ' A' ' 7' ' ' TRP . 7.0 tpp180 71.06 33.44 2.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.33 179.442 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ptt85 -51.97 -91.9 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.741 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.7 pt -79.75 -11.21 12.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.292 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -51.69 -54.39 25.09 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.607 179.9 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -44.56 -18.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.077 0.465 . . . . 0.0 110.026 178.919 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -95.09 -32.77 6.91 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.733 -179.845 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.478 HG23 ' N ' ' A' ' 16' ' ' LYS . 33.1 m -126.9 -42.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 117.486 0.643 . . . . 0.0 112.008 -179.071 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.478 ' N ' HG23 ' A' ' 15' ' ' VAL . 18.4 mmmt -54.4 -54.46 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.64 -179.239 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.0 tt -65.56 0.34 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.099 0.476 . . . . 0.0 109.978 179.766 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.444 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.7 mt 62.51 100.87 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.483 179.809 . . . . . . . . 2 2 . 1 . 100 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.42 -74.43 0.02 OUTLIER Glycine 0 C--N 1.33 0.221 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.83 179.997 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.55 -29.06 74.16 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.84 179.884 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.18 -58.97 6.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 110.543 179.951 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.55 -38.88 70.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.526 179.911 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tp -76.09 68.31 2.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.463 -179.958 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -166.92 -28.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.487 179.922 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -67.13 -56.69 8.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.455 179.942 . . . . . . . . 1 1 . 1 . 100 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.5 mt . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.437 179.867 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.27 0 N-CA-C 111.99 -0.444 . . . . 0.0 111.99 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -165.93 19.35 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.395 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 8.7 tpp85 -56.47 -28.86 60.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.435 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -147.29 146.57 29.78 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.311 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.3 mmt85 -61.06 85.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.571 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 49.04 72.05 0.33 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.745 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 61.3 t-105 -167.19 0.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.732 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.552 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.47 -68.67 0.16 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.856 0.36 . . . . 0.0 110.139 -179.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.2 tpt180 -171.68 16.25 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.286 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 ptp180 -48.14 -87.14 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.7 pt -89.8 -12.48 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 179.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.85 -41.15 66.51 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 110.734 -0.946 . . . . 0.0 110.734 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -45.52 -16.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.054 0.454 . . . . 0.0 110.576 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -103.64 -42.15 2.04 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.967 -0.56 . . . . 0.0 112.513 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -105.63 -40.37 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 116.939 0.369 . . . . 0.0 111.258 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 12' ' ' GLY . 81.7 tttt -59.37 -51.03 71.66 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.904 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 tp -74.98 14.86 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.095 0.474 . . . . 0.0 110.101 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.448 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.5 mt 62.11 108.44 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.517 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.07 -87.65 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.851 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -73.65 -20.1 79.77 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 121.137 -0.554 . . . . 0.0 111.897 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.29 -64.83 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.726 0.298 . . . . 0.0 110.628 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.6 -46.25 89.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.465 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.436 ' C ' ' H ' ' A' ' 25' ' ' HIS . 12.6 mt -82.31 -156.44 0.17 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.539 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 94.4 m-20 53.25 9.89 0.17 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.826 179.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.436 ' H ' ' C ' ' A' ' 23' ' ' LEU . 89.9 m-70 -155.34 53.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.3 mt . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.573 -179.118 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 32.9 ptt85 -171.86 52.58 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.825 0.345 . . . . 0.0 110.526 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -52.92 -13.52 0.44 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.589 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -161.68 61.59 0.26 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.365 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.8 mtp180 47.3 -175.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -79.88 65.5 5.06 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.403 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' C ' ' H ' ' A' ' 9' ' ' ARG . 98.9 m95 -151.65 -2.27 0.31 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.98 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -68.06 8.39 0.42 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.05 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 7' ' ' TRP . 9.7 mmt-85 63.17 47.49 4.1 Favored 'General case' 0 CA--C 1.522 -0.121 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.018 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.0 ptt180 -52.87 -83.38 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.174 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.3 tt -87.96 -16.64 8.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 178.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.35 -39.8 83.82 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.453 179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -49.54 -15.53 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.114 0.483 . . . . 0.0 109.886 179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.454 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.48 -44.26 2.18 Favored Glycine 0 C--N 1.336 0.544 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.447 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.8 m -103.38 -41.66 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-N 116.979 0.389 . . . . 0.0 111.038 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 2.9 tppp? -59.1 -38.04 78.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.798 0.332 . . . . 0.0 110.507 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.52 HG23 ' H ' ' A' ' 18' ' ' ILE . 5.5 tp -50.06 -54.88 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.966 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.52 ' H ' HG23 ' A' ' 17' ' ' ILE . 3.2 pt -152.74 76.06 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 177.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.42 88.3 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 CA-C-N 116.054 -0.521 . . . . 0.0 112.234 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . -53.09 -16.98 4.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 121.035 -0.602 . . . . 0.0 111.635 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.2 16.23 0.48 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.946 0.403 . . . . 0.0 110.204 179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.446 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -157.38 -51.64 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.11 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.544 HD12 ' N ' ' A' ' 23' ' ' LEU . 9.7 mp -82.4 17.73 1.64 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.96 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.2 t0 -166.14 40.08 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.544 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -73.0 111.51 8.18 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.515 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.5 mt . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.522 -179.965 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.981 -0.447 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -73.44 73.92 1.4 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.761 0.315 . . . . 0.0 110.609 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -67.26 -46.35 73.96 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.533 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.2 pttt -169.66 73.19 0.08 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.574 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 52.65 175.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.625 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.52 ' CD ' ' N ' ' A' ' 6' ' ' LYS . 0.2 OUTLIER -75.52 91.64 2.82 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.218 -179.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.443 ' C ' ' H ' ' A' ' 9' ' ' ARG . 59.1 t90 -169.69 -6.53 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.343 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.77 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -63.3 2.58 0.37 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.516 -179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.572 ' NH2' ' NZ ' ' A' ' 16' ' ' LYS . 20.5 mmt180 62.69 37.36 12.79 Favored 'General case' 0 CA--C 1.521 -0.157 0 CA-C-O 120.674 0.273 . . . . 0.0 110.663 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -48.11 -92.83 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.3 pt -88.16 -8.89 10.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 178.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.88 -39.71 97.27 Favored Glycine 0 C--N 1.335 0.503 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.214 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -51.17 -15.4 0.35 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.68 -40.76 3.53 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.314 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.437 HG23 ' N ' ' A' ' 16' ' ' LYS . 23.7 m -113.73 -42.85 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-N 116.805 0.303 . . . . 0.0 111.525 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.572 ' NZ ' ' NH2' ' A' ' 9' ' ' ARG . 85.2 tttt -51.17 -55.88 15.63 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.711 -0.396 . . . . 0.0 110.581 -179.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.532 ' O ' HG23 ' A' ' 17' ' ' ILE . 3.4 tp -77.13 39.33 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-O 121.154 0.502 . . . . 0.0 110.022 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' H ' ' C ' ' A' ' 16' ' ' LYS . 23.8 pt 34.64 56.21 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.57 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.29 173.46 51.03 Favored Glycine 0 N--CA 1.453 -0.213 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.067 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -52.14 -19.39 5.56 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.898 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.11 -53.34 58.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.893 0.378 . . . . 0.0 110.467 179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.26 -40.8 64.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.489 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.6 mt -80.94 57.04 2.94 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.69 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 26' ' ' LEU . 30.2 t70 -171.27 -21.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.547 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -76.17 37.08 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.713 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.546 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.735 179.9 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 51.06 52.34 15.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.782 0.325 . . . . 0.0 110.606 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -69.23 -13.02 62.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.493 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -142.87 -78.11 0.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.384 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.8 tpp85 -171.16 59.85 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.381 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.1 mttt 52.0 64.8 1.71 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.494 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.478 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 32.3 t90 -171.77 10.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.513 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.578 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.06 -92.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -166.73 25.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.298 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.538 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 20.1 ptt-85 -46.16 -60.83 2.06 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.531 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.538 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 1.1 pt -117.67 -13.46 10.58 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.388 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.24 -34.01 72.41 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 178.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.1 ttpp -50.73 -18.12 0.66 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.066 0.46 . . . . 0.0 109.837 178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -98.49 -44.66 2.47 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.277 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.4 m -103.66 -42.02 7.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 CA-C-N 116.792 0.296 . . . . 0.0 111.205 -179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.1 tttp -61.79 -31.55 71.78 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.881 -0.328 . . . . 0.0 110.549 -179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 tt -66.93 4.11 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-O 120.995 0.426 . . . . 0.0 110.072 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.1 mm 62.64 88.4 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.172 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.177 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.95 -64.98 0.02 OUTLIER Glycine 0 C--N 1.331 0.266 0 C-N-CA 121.105 -0.569 . . . . 0.0 111.959 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -69.01 -40.69 83.81 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.119 -0.562 . . . . 0.0 111.998 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.6 -55.22 27.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.772 0.32 . . . . 0.0 110.546 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.31 -31.46 72.08 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.516 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.0 tp -77.37 42.93 0.36 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.332 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -171.9 -35.74 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.505 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 51.27 88.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.523 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.527 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.031 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.264 0 N-CA-C 111.953 -0.459 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 59.6 mtt-85 56.5 70.76 0.62 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.855 0.359 . . . . 0.0 110.611 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 71.0 ttt180 -76.83 -31.92 57.22 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.462 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -162.18 37.83 0.12 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.439 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 19.6 mmt180 54.31 93.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.481 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' CD ' ' N ' ' A' ' 6' ' ' LYS . 3.8 mptp? 54.12 169.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.299 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.411 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 65.2 t-105 62.59 14.02 6.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.405 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -60.23 -81.41 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 179.141 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.1 16.67 0.06 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.004 0.43 . . . . 0.0 110.234 179.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -40.46 -89.81 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.799 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -79.87 -19.22 12.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.929 0.395 . . . . 0.0 110.081 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.596 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.14 -54.26 27.07 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 121.091 -0.576 . . . . 0.0 112.313 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.443 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 19.0 pttm -43.53 -19.01 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.338 -0.507 . . . . 0.0 110.432 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -92.6 -39.91 5.16 Favored Glycine 0 C--N 1.336 0.58 0 N-CA-C 111.259 -0.736 . . . . 0.0 111.259 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.437 HG23 ' N ' ' A' ' 16' ' ' LYS . 15.4 m -112.93 -47.53 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.512 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.596 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.3 tttt -56.18 -37.61 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 178.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.443 ' CG2' ' O ' ' A' ' 13' ' ' LYS . 8.0 tt -51.73 -7.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.88 179.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.517 ' H ' ' C ' ' A' ' 16' ' ' LYS . 7.6 mt 70.15 66.95 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.006 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -81.21 129.22 8.9 Favored Glycine 0 C--N 1.332 0.308 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.952 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.404 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -74.44 -2.33 63.21 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 121.183 -0.532 . . . . 0.0 111.901 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.59 16.84 0.45 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.709 0.29 . . . . 0.0 110.577 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.404 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -168.1 -47.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.503 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.592 HD12 ' N ' ' A' ' 23' ' ' LEU . 8.1 mp -78.76 51.11 1.06 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.04 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 49.0 t0 -164.17 -42.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.432 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -73.7 -20.53 60.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.448 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.532 0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.785 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.349 0 N-CA-C 111.931 -0.467 . . . . 0.0 111.931 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.83 33.87 0.22 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.79 0.328 . . . . 0.0 110.553 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 -76.19 -18.33 59.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.654 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.43 ' O ' ' N ' ' A' ' 6' ' ' LYS . 61.5 tttp -166.81 71.54 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.88 0.371 . . . . 0.0 110.757 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.8 mtm-85 45.09 -93.43 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.117 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.43 ' N ' ' O ' ' A' ' 4' ' ' LYS . 79.5 mttt -145.8 77.4 1.5 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.552 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.486 ' O ' ' CE3' ' A' ' 7' ' ' TRP . 55.2 t90 -166.49 6.52 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.363 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.58 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.66 -73.25 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.264 -179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.34 13.53 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.188 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -39.75 -90.07 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.2 pt -82.82 -3.4 7.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -61.75 -47.37 90.75 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.863 -0.895 . . . . 0.0 110.863 179.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -43.13 -19.97 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.078 0.466 . . . . 0.0 110.249 178.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -93.83 -41.46 4.38 Favored Glycine 0 C--N 1.334 0.457 0 CA-C-N 115.686 -0.688 . . . . 0.0 112.154 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.405 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.1 m -111.42 -43.15 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 CA-C-N 116.908 0.354 . . . . 0.0 111.526 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 59.3 tttm -46.45 -52.03 13.95 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 121.002 -0.279 . . . . 0.0 110.811 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.9 mm -45.05 -59.15 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.326 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.686 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 20.5 tt -171.63 -17.19 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.76 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.79 63.41 5.12 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.835 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -167.81 -60.2 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 121.202 -0.523 . . . . 0.0 111.95 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.2 -65.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.854 0.359 . . . . 0.0 110.466 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.0 -28.55 66.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.406 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 tp -55.07 -19.73 7.94 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.165 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.474 ' O ' ' N ' ' A' ' 26' ' ' LEU . 22.3 t70 -160.29 61.02 0.34 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.395 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 38.8 t60 -49.18 90.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.655 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.474 ' N ' ' O ' ' A' ' 24' ' ' ASP . 31.3 tp . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.298 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.517 ' CZ ' HH12 ' A' ' 5' ' ' ARG . 52.3 mtp180 -74.24 -72.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.733 0.301 . . . . 0.0 110.573 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 82.5 mtm180 51.24 -99.56 0.08 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.322 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -87.07 123.34 32.04 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.264 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.517 HH12 ' CZ ' ' A' ' 2' ' ' ARG . 23.9 mmt180 -51.97 97.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.325 -179.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.2 pttp 32.45 80.91 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.729 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.494 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 55.9 t-105 -168.13 -6.54 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.927 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.62 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.7 pt? -75.17 21.09 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.29 -179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.409 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.8 mmt-85 62.27 39.67 12.23 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 120.819 0.343 . . . . 0.0 110.462 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' O ' ' O ' ' A' ' 9' ' ' ARG . 3.0 ptp180 -48.32 -93.4 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.188 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.3 pt -83.77 -7.18 10.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -64.83 -43.04 96.7 Favored Glycine 0 C--N 1.337 0.608 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.704 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.35 -13.49 0.36 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.264 0.554 . . . . 0.0 109.551 178.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.47 -42.43 3.42 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.06 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.44 HG23 ' N ' ' A' ' 16' ' ' LYS . 23.6 m -112.93 -43.09 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 116.751 0.276 . . . . 0.0 111.031 -179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.7 tttt -57.76 -32.22 67.27 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.714 0.293 . . . . 0.0 110.611 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -67.23 3.01 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.2 mt 60.76 84.58 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.38 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.78 25.39 0.14 Allowed Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.841 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -167.79 -57.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 121.195 -0.526 . . . . 0.0 111.909 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.86 -54.0 34.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.786 0.327 . . . . 0.0 110.505 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.49 ' O ' ' NE2' ' A' ' 25' ' ' HIS . . . -65.89 -23.98 66.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.606 -179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.7 mt -84.24 65.06 8.63 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.488 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -160.16 -38.36 0.05 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.308 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.49 ' NE2' ' O ' ' A' ' 22' ' ' ALA . 13.0 p80 -77.01 131.3 38.37 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.582 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.566 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.104 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.265 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.486 ' O ' ' N ' ' A' ' 4' ' ' LYS . 67.6 mtp180 -69.92 -76.31 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.683 0.278 . . . . 0.0 110.57 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 29.4 mmt-85 59.3 -77.09 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.913 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.504 ' O ' ' N ' ' A' ' 6' ' ' LYS . 6.1 ptmm? -158.28 70.13 0.53 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.018 0.437 . . . . 0.0 110.695 -179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.2 mtm180 56.27 -79.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.059 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.504 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.7 mttm -140.04 -157.87 0.81 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.602 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' C ' ' H ' ' A' ' 9' ' ' ARG . 11.2 t-105 73.53 -29.51 0.2 Allowed 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.909 179.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.65 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.9 pt? -51.1 -10.37 0.07 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.596 -0.442 . . . . 0.0 111.195 -179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 7' ' ' TRP . 12.3 tpp180 73.62 41.09 0.46 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.753 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -55.56 -91.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.8 pt -85.93 -13.79 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.15 -47.73 60.3 Favored Glycine 0 CA--C 1.508 -0.359 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -43.71 -20.06 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.308 0.575 . . . . 0.0 109.969 178.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -94.14 -44.19 3.6 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.549 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.3 m -104.19 -43.05 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 117.303 0.552 . . . . 0.0 111.037 -179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . 20.2 tptp -47.48 -68.85 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.624 -0.262 . . . . 0.0 110.981 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.4 ' O ' ' O ' ' A' ' 18' ' ' ILE . 20.3 pt -74.87 33.48 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.91 -0.316 . . . . 0.0 111.168 -179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.446 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 51.08 100.48 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.732 0.301 . . . . 0.0 110.555 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.38 130.07 46.14 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.926 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -49.45 135.51 23.52 Favored Glycine 0 N--CA 1.452 -0.264 0 N-CA-C 111.624 -0.591 . . . . 0.0 111.624 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.13 20.77 1.9 Allowed 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 120.627 -0.429 . . . . 0.0 109.928 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 56.84 45.56 21.35 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 24.4 mt 55.54 22.12 4.94 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 -177.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 p30 42.7 47.91 4.71 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.95 -178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.407 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 56.1 t60 -77.15 39.28 0.24 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 114.384 -1.28 . . . . 0.0 110.726 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 26' ' ' LEU . 10.1 mp . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.066 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.1 ptm180 -172.7 43.13 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.757 0.313 . . . . 0.0 110.724 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.606 HH22 ' HZ3' ' A' ' 4' ' ' LYS . 33.5 ttp85 -59.99 -49.27 78.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.242 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.606 ' HZ3' HH22 ' A' ' 3' ' ' ARG . 50.9 mttp -83.97 -79.14 0.21 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.073 0.463 . . . . 0.0 110.314 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.4 ttm-85 -170.23 -80.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.994 -179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.4 mttt -154.36 55.14 0.69 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.237 -0.438 . . . . 0.0 109.913 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 5.1 m-90 -151.76 -5.93 0.25 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.382 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -53.38 -85.38 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.9 ppt_? -163.53 18.48 0.07 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.746 0.308 . . . . 0.0 111.004 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -44.15 -89.79 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 109.986 -0.376 . . . . 0.0 109.986 179.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.9 tp -77.23 -19.51 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.75 -40.86 89.88 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 111.367 -0.693 . . . . 0.0 111.367 179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -46.37 -17.17 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.978 0.418 . . . . 0.0 110.461 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.46 -41.41 2.55 Favored Glycine 0 C--N 1.336 0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 112.467 -179.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -107.37 -41.08 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 CA-C-N 116.824 0.312 . . . . 0.0 111.098 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 12' ' ' GLY . 40.6 tptt -66.67 -31.06 71.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.631 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.4 tt -45.28 -24.03 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.212 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.103 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.586 HG23 ' N ' ' A' ' 19' ' ' GLY . 16.9 tt -159.92 -48.82 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.204 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.796 179.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.586 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 159.07 3.31 0.07 OUTLIER Glycine 0 C--N 1.332 0.307 0 C-N-CA 121.204 -0.522 . . . . 0.0 112.124 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 64.08 3.9 10.05 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.015 -0.612 . . . . 0.0 111.813 -179.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.38 9.42 1.04 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.923 0.392 . . . . 0.0 110.404 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -160.87 -44.15 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.23 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.499 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.2 mm? -80.75 57.32 2.95 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.974 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.427 ' O ' HD23 ' A' ' 26' ' ' LEU . 30.3 t70 -167.99 -50.22 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.658 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.9 m80 -93.24 72.07 4.53 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.617 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' H ' HD23 ' A' ' 26' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.87 0.367 . . . . 0.0 110.121 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 111.932 -0.467 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 53.91 62.92 2.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.869 0.366 . . . . 0.0 110.508 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 60.2 mtp180 -85.3 -20.86 29.36 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.503 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -134.54 46.62 2.46 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.364 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.6 mtt180 42.57 -108.82 0.11 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.078 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.488 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 65.5 mmtt -114.48 68.95 0.7 Allowed 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.32 179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.4 m-90 -154.52 -10.44 0.13 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.23 179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.738 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -69.1 5.54 1.17 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.06 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.408 ' H ' ' C ' ' A' ' 7' ' ' TRP . 37.9 mmm-85 60.54 43.54 12.79 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.75 179.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.2 ptm180 -52.7 -89.06 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.6 pt -86.24 -10.07 11.22 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.196 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 178.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.453 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -60.52 -40.33 97.61 Favored Glycine 0 C--N 1.336 0.542 0 N-CA-C 110.931 -0.868 . . . . 0.0 110.931 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -52.3 -13.01 0.29 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . -104.25 -42.15 1.95 Allowed Glycine 0 C--N 1.336 0.577 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.742 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.95 -39.7 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 117.184 0.492 . . . . 0.0 111.054 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.452 ' N ' ' O ' ' A' ' 12' ' ' GLY . 5.5 tmtt? -56.55 -64.48 0.85 Allowed 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.0 tt -74.44 6.73 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 17.3 mt 62.08 109.25 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.475 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -173.9 -109.62 0.23 Allowed Glycine 0 N--CA 1.452 -0.299 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.769 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 47.41 -110.5 0.6 Allowed Glycine 0 N--CA 1.452 -0.24 0 C-N-CA 121.214 -0.517 . . . . 0.0 112.051 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -164.52 97.34 0.78 Allowed 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.701 179.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 58.51 56.65 4.2 Favored 'General case' 0 CA--C 1.516 -0.329 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 19.2 mt 59.23 20.02 8.1 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -177.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.0 p30 43.33 38.63 1.77 Allowed 'General case' 0 C--N 1.342 0.254 0 CA-C-O 122.127 0.965 . . . . 0.0 109.452 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -55.56 -72.13 0.07 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 113.665 -1.607 . . . . 0.0 110.939 -179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.4 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.471 -179.957 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.0 mtt-85 52.55 72.18 0.42 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.846 0.355 . . . . 0.0 110.434 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -57.06 -43.52 82.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.762 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.508 ' O ' ' N ' ' A' ' 6' ' ' LYS . 38.2 mttm -142.42 44.35 1.63 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.437 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 58.0 -78.14 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.549 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 4' ' ' LYS . 80.6 mttt -136.19 -164.21 1.52 Allowed 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.189 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.457 ' C ' ' HE ' ' A' ' 9' ' ' ARG . 14.0 t90 72.9 -35.0 0.31 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.186 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.1 pt? -68.03 3.17 1.68 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.125 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.757 ' H ' ' HE ' ' A' ' 9' ' ' ARG . 4.1 mmp_? 55.68 50.99 13.22 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.84 0.353 . . . . 0.0 110.509 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.474 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 14.9 ptt-85 -49.26 -53.92 19.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.472 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.474 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 12.5 tt -121.48 -19.3 4.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 178.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.448 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -56.33 -35.74 66.79 Favored Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.35 -0.841 . . . . 0.0 111.047 179.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.91 -12.34 0.31 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.236 0.541 . . . . 0.0 109.737 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.78 -44.66 1.62 Allowed Glycine 0 C--N 1.334 0.427 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.416 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.44 -41.86 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 CA-C-N 116.991 0.396 . . . . 0.0 111.298 -179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' N ' ' O ' ' A' ' 12' ' ' GLY . 56.9 mttp -68.55 -34.39 75.75 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.229 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.465 HG23 ' N ' ' A' ' 18' ' ' ILE . 8.6 tp -50.56 -39.26 17.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.811 0.339 . . . . 0.0 110.44 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.465 ' N ' HG23 ' A' ' 17' ' ' ILE . 4.4 tp -103.28 -19.07 6.35 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.18 -179.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -41.62 -26.72 0.27 Allowed Glycine 0 C--N 1.331 0.255 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.582 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.21 -57.5 3.65 Favored Glycine 0 C--N 1.329 0.178 0 C-N-CA 121.197 -0.525 . . . . 0.0 111.932 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.45 -35.48 19.61 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.983 0.421 . . . . 0.0 110.127 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -84.72 -50.66 7.43 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.979 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.7 tp -80.07 69.39 6.45 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.355 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -168.84 -36.81 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.448 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -71.84 81.04 0.89 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.546 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 pp . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.636 -179.884 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 111.879 -0.489 . . . . 0.0 111.879 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.493 ' NE ' ' NZ ' ' A' ' 6' ' ' LYS . 75.4 ttt180 -54.38 -16.92 2.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.878 0.37 . . . . 0.0 110.223 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -59.61 -16.0 22.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.79 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -86.04 11.05 12.49 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.87 0.367 . . . . 0.0 110.289 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 57.16 66.38 1.18 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.421 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.493 ' NZ ' ' NE ' ' A' ' 2' ' ' ARG . 62.6 mmtt 58.1 88.36 0.06 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.736 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.43 ' H ' ' H ' ' A' ' 8' ' ' LEU . 63.1 t-105 -169.36 -8.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.577 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -39.33 -70.67 0.1 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.768 179.804 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.75 8.34 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.037 -0.529 . . . . 0.0 109.833 179.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.452 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 4.2 ptm180 -33.43 -48.09 0.24 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.282 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.452 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 9.4 tt -126.35 -18.25 2.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 178.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.33 -37.74 82.85 Favored Glycine 0 N--CA 1.448 -0.515 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.96 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -51.47 -13.9 0.26 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.185 0.517 . . . . 0.0 109.741 178.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.15 -46.15 1.92 Allowed Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.194 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.3 m -104.54 -40.01 5.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 116.872 0.336 . . . . 0.0 111.219 -179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' A' ' 12' ' ' GLY . 54.0 tttm -60.08 -35.81 76.0 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.556 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.3 tp -70.07 4.05 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 CA-C-O 121.223 0.535 . . . . 0.0 109.981 179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.414 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.6 mm 58.13 87.51 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.093 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.13 21.75 0.13 Allowed Glycine 0 N--CA 1.452 -0.26 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -172.38 -37.26 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.747 -0.541 . . . . 0.0 111.747 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.22 -78.79 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.305 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.16 -27.99 53.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.387 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.6 tp -78.52 53.8 1.36 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.486 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -170.28 -4.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.356 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 33.8 t-80 -66.73 -75.24 0.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.566 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.51 ' N ' ' CD2' ' A' ' 26' ' ' LEU . 2.2 mm? . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.083 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.462 ' O ' ' N ' ' A' ' 4' ' ' LYS . 34.8 ptt85 -166.04 -34.41 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.81 0.338 . . . . 0.0 110.422 179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.423 ' C ' ' H ' ' A' ' 5' ' ' ARG . 78.9 mtm180 48.9 -90.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.877 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.515 ' O ' ' N ' ' A' ' 6' ' ' LYS . 86.1 mttt -77.21 36.08 0.18 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.762 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 3' ' ' ARG . 98.2 mtt180 57.14 -78.59 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.823 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 4' ' ' LYS . 15.1 ptpt -159.97 66.34 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.073 0.463 . . . . 0.0 110.183 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.476 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 75.6 t-105 -155.42 11.85 0.33 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.665 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.41 69.47 4.62 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.996 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 48.49 27.47 1.43 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.933 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -51.01 -89.27 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -83.88 -17.74 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.086 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.01 -46.27 69.81 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.994 -0.622 . . . . 0.0 112.194 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.3 -14.49 0.17 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.01 0.433 . . . . 0.0 110.047 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.55 -33.36 5.92 Favored Glycine 0 C--N 1.334 0.437 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.415 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.429 HG23 ' N ' ' A' ' 16' ' ' LYS . 25.7 m -122.58 -42.3 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 116.895 0.347 . . . . 0.0 111.044 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.8 tttt -56.67 -34.42 67.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.784 0.326 . . . . 0.0 110.431 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.8 tt -62.66 -1.0 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.373 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.46 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.8 mt 63.48 88.94 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.356 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -166.48 22.76 0.12 Allowed Glycine 0 N--CA 1.451 -0.353 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.734 -179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -172.05 -23.72 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.98 11.75 0.83 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.937 0.399 . . . . 0.0 110.358 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.434 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.96 -44.69 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.161 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.8 mt -79.88 54.93 1.96 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.384 179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.433 ' C ' ' H ' ' A' ' 26' ' ' LEU . 24.0 t0 -162.65 -16.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.387 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' ASP . 12.3 m-70 -76.78 35.44 0.15 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.6 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' A' ' 24' ' ' ASP . 14.8 mt . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.523 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 111.966 -0.453 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 60.7 mtp180 -73.37 74.4 1.37 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.729 0.299 . . . . 0.0 110.588 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 73.0 mtp180 -70.54 -62.34 1.43 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.542 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 80.2 mttt -96.73 49.12 1.08 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.284 -0.417 . . . . 0.0 110.685 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 53.63 -85.1 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.672 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' LYS . 92.9 mttt -142.88 78.41 1.61 Allowed 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.278 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.481 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 77.0 t-105 -170.61 8.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.461 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -75.2 -92.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.051 179.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.489 ' O ' ' N ' ' A' ' 11' ' ' ILE . 1.2 ppt_? -170.17 25.03 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.469 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.634 ' C ' ' H ' ' A' ' 12' ' ' GLY . 7.4 ptp180 -60.31 78.71 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.433 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.489 ' N ' ' O ' ' A' ' 9' ' ' ARG . 6.8 pt 55.77 -11.17 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.546 -178.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.634 ' H ' ' C ' ' A' ' 10' ' ' ARG . . . -72.55 -24.56 76.0 Favored Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 178.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.9 ttpp -53.45 -15.76 1.19 Allowed 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.426 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.22 -49.58 1.05 Allowed Glycine 0 C--N 1.337 0.602 0 CA-C-N 115.613 -0.721 . . . . 0.0 112.652 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 20.6 m -96.63 -35.04 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-N 117.014 0.407 . . . . 0.0 111.538 -179.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.459 ' N ' ' O ' ' A' ' 12' ' ' GLY . 61.4 tttm -76.87 -29.14 55.67 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 121.02 -0.272 . . . . 0.0 111.118 -179.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.3 tp -55.13 -32.67 28.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.624 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.44 ' C ' ' H ' ' A' ' 20' ' ' GLY . 9.6 tt -167.54 -23.67 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.187 0 C-N-CA 120.839 -0.344 . . . . 0.0 110.908 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.23 17.92 1.31 Allowed Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.2 -0.524 . . . . 0.0 112.36 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.447 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -167.07 -47.09 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 121.21 -0.519 . . . . 0.0 111.831 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.87 2.25 1.51 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.915 0.388 . . . . 0.0 110.298 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -153.54 -38.13 0.1 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.227 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.6 tp -79.95 51.89 1.41 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.367 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.445 ' H ' ' H ' ' A' ' 25' ' ' HIS . 39.0 t70 -166.48 -9.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.66 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.445 ' H ' ' H ' ' A' ' 24' ' ' ASP . 38.4 t60 -70.0 -60.08 2.52 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.689 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.447 179.971 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 111.965 -0.454 . . . . 0.0 111.965 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.575 ' NH2' ' HZ1' ' A' ' 6' ' ' LYS . 54.7 mtp180 52.3 44.56 29.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.891 0.377 . . . . 0.0 110.496 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.1 mtt85 -74.08 -2.34 24.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.656 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.4 tttp -161.68 71.24 0.36 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.588 -179.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.5 mtm105 49.42 -108.65 0.31 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.665 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.575 ' HZ1' ' NH2' ' A' ' 2' ' ' ARG . 58.1 mttm -145.9 90.93 2.03 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.779 0.323 . . . . 0.0 110.223 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.486 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 30.7 t-105 -167.49 -14.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.765 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.566 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.55 -78.54 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.165 -179.677 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.507 ' O ' ' N ' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -177.37 18.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.561 -0.291 . . . . 0.0 110.574 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.632 ' C ' ' H ' ' A' ' 12' ' ' GLY . 4.6 ptp180 -57.5 78.17 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.313 -179.341 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 9' ' ' ARG . 2.2 mm 61.72 -18.25 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.239 -179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.632 ' H ' ' C ' ' A' ' 10' ' ' ARG . . . -66.37 -30.4 76.57 Favored Glycine 0 N--CA 1.441 -1.012 0 N-CA-C 110.049 -1.22 . . . . 0.0 110.049 178.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -52.43 -14.16 0.45 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.079 0.466 . . . . 0.0 109.786 178.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -108.53 -46.64 0.97 Allowed Glycine 0 C--N 1.337 0.595 0 CA-C-N 115.771 -0.649 . . . . 0.0 112.569 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 29.4 m -99.19 -34.19 4.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 CA-C-N 117.068 0.434 . . . . 0.0 111.518 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.435 ' N ' ' O ' ' A' ' 12' ' ' GLY . 52.8 tttp -74.22 -39.7 62.93 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.03 -179.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.1 tt -51.87 -37.57 21.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 C-N-CA 120.825 -0.35 . . . . 0.0 110.298 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 1.1 pt -105.27 -96.37 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.462 -0.569 . . . . 0.0 109.462 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.428 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 171.69 12.92 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.98 -10.07 3.42 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 121.11 -0.567 . . . . 0.0 111.866 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -66.57 -52.25 47.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.765 0.317 . . . . 0.0 110.345 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.425 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -63.95 -34.42 77.93 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.427 179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.3 tp -76.26 38.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.293 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.425 ' H ' ' C ' ' A' ' 22' ' ' ALA . 37.9 t70 -168.31 -58.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.575 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.8 t-80 51.14 56.33 8.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.508 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.562 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.7 mp . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.064 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.426 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.261 0 N-CA-C 111.938 -0.465 . . . . 0.0 111.938 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.0 mtm-85 -76.32 36.16 0.15 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.751 0.31 . . . . 0.0 110.585 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.426 ' H ' ' C ' ' A' ' 1' ' ' GLY . 61.8 mtt-85 -78.47 -29.47 46.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.642 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -144.55 23.11 1.62 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.434 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 57.21 65.45 1.37 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.577 179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp 48.07 85.4 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.649 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.514 ' H ' HD23 ' A' ' 8' ' ' LEU . 41.9 t-105 -166.74 -19.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.574 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.711 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.7 pt? -52.05 -10.35 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.94 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 7' ' ' TRP . 7.7 tpp180 72.95 33.9 1.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.501 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HE ' HG22 ' A' ' 11' ' ' ILE . 5.6 ptm180 -50.72 -91.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 179.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.404 HG22 ' HE ' ' A' ' 10' ' ' ARG . 17.6 tt -84.22 -20.38 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.273 179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.484 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.75 -42.2 58.84 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.864 -0.684 . . . . 0.0 111.706 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -46.23 -16.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.096 0.474 . . . . 0.0 110.436 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -100.77 -42.52 2.46 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.551 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.3 m -105.53 -41.02 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 CA-C-N 116.996 0.398 . . . . 0.0 111.29 -179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.9 tttp -55.32 -51.14 67.7 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.868 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.9 tp -74.23 14.96 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.379 0 CA-C-O 121.064 0.459 . . . . 0.0 110.442 -179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.435 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mm 57.14 101.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.402 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.82 92.62 0.82 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.197 -0.525 . . . . 0.0 112.005 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -58.15 -159.04 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.852 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.71 14.47 0.18 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.072 0.463 . . . . 0.0 110.293 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.443 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -171.98 -61.17 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.057 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 tt -83.81 44.73 1.01 Allowed 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -164.78 14.35 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.472 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.469 ' O ' ' ND1' ' A' ' 25' ' ' HIS . 0.0 OUTLIER -56.56 137.23 53.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.635 -179.973 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.0 mp . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.121 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.252 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.438 ' C ' ' H ' ' A' ' 4' ' ' LYS . 14.3 ptm180 -161.89 30.73 0.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.842 0.353 . . . . 0.0 110.414 -179.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -54.16 -9.92 0.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.486 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.438 ' H ' ' C ' ' A' ' 2' ' ' ARG . 32.3 ttmt -168.24 62.5 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.399 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.7 mmt-85 47.4 -174.71 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.603 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.436 ' O ' ' CZ ' ' A' ' 10' ' ' ARG . 78.7 mttt -82.69 76.17 9.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.406 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 18.7 t90 -168.64 0.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.524 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.536 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.46 -65.33 0.58 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.247 -0.433 . . . . 0.0 109.908 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.0 tpp85 -169.63 22.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.179 179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' CZ ' ' O ' ' A' ' 6' ' ' LYS . 7.0 ptt180 -48.88 -89.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 tp -78.16 -21.38 13.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.53 -35.79 68.09 Favored Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 5.5 ttpm? -49.47 -14.78 0.12 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.1 -45.0 1.53 Allowed Glycine 0 C--N 1.336 0.577 0 CA-C-N 115.882 -0.599 . . . . 0.0 112.426 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -101.92 -39.36 6.46 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 116.844 0.322 . . . . 0.0 110.934 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 37.3 tptt -68.3 -34.04 75.42 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.807 0.337 . . . . 0.0 110.46 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.743 HG23 ' H ' ' A' ' 18' ' ' ILE . 9.1 tt -47.71 -64.93 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.455 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.743 ' H ' HG23 ' A' ' 17' ' ' ILE . 9.6 pt -157.34 37.79 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 177.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -73.83 22.15 1.2 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 121.22 -0.514 . . . . 0.0 111.997 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 18' ' ' ILE . . . 79.87 -15.63 14.61 Favored Glycine 0 C--N 1.33 0.243 0 N-CA-C 111.94 -0.464 . . . . 0.0 111.94 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.74 -64.48 0.85 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.808 0.337 . . . . 0.0 110.426 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.19 -35.97 69.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.484 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 21.5 tp -77.06 68.6 3.23 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.249 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.402 ' H ' ' H ' ' A' ' 25' ' ' HIS . 11.2 t70 -167.17 -12.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.419 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.444 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 0.5 OUTLIER -55.3 139.44 42.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.608 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' N ' ' CD2' ' A' ' 26' ' ' LEU . 2.4 mm? . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.085 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.41 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.266 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.562 ' NH1' HH22 ' A' ' 5' ' ' ARG . 4.7 ptp180 -46.17 94.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.16 0.505 . . . . 0.0 110.783 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.41 ' N ' ' O ' ' A' ' 1' ' ' GLY . 94.8 mtt180 -66.29 -30.46 70.89 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.529 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -164.67 65.93 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.502 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.562 HH22 ' NH1' ' A' ' 2' ' ' ARG . 15.9 mmm180 49.9 17.82 0.31 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.563 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 53.6 mttm 55.94 78.49 0.2 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.404 -179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.471 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 30.0 t90 -168.18 5.23 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.759 -179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.46 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -55.0 -88.38 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.331 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 8.4 mmm180 -140.23 9.24 2.29 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.266 -179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -42.33 -86.22 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 120.691 0.281 . . . . 0.0 110.583 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -87.45 -17.26 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.64 -41.4 82.01 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.4 179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -49.51 -16.1 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.092 0.472 . . . . 0.0 109.99 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.454 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.05 -39.0 3.91 Favored Glycine 0 C--N 1.333 0.41 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.513 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.6 m -113.79 -42.1 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 CA-C-N 116.94 0.37 . . . . 0.0 111.365 -179.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . 56.2 tttp -51.04 -51.03 57.2 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.844 -0.342 . . . . 0.0 110.615 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.5 tt -77.8 38.33 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 121.325 0.584 . . . . 0.0 110.09 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.437 ' H ' ' C ' ' A' ' 16' ' ' LYS . 30.0 pt 35.17 51.32 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.725 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.511 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . 74.79 -75.88 1.23 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.878 -0.489 . . . . 0.0 111.878 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 46.61 -88.1 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 N-CA-C 111.611 -0.596 . . . . 0.0 111.611 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -49.36 -29.22 5.89 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.92 -51.01 4.41 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.075 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 15.0 tp -75.25 73.62 2.36 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.988 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 21.1 p-10 -172.11 -22.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.223 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 46.9 t-80 -65.07 -6.34 8.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.397 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.53 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.8 mp . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.143 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 111.884 -0.486 . . . . 0.0 111.884 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -166.03 130.0 2.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.932 0.396 . . . . 0.0 110.645 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -171.76 -30.96 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.274 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.5 tttm -164.66 60.06 0.14 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.233 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 49.4 mtp85 48.63 -172.17 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.68 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.478 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 22.7 mtmm -80.36 70.84 7.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.996 0.427 . . . . 0.0 110.56 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.478 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 95.6 m95 -158.81 -3.45 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.85 -0.613 . . . . 0.0 109.596 179.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.504 ' N ' HD23 ' A' ' 8' ' ' LEU . 0.9 OUTLIER -68.87 8.77 0.47 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.073 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.441 ' H ' ' C ' ' A' ' 7' ' ' TRP . 19.6 mmt180 64.2 44.2 4.56 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.054 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.1 ptp180 -51.95 -93.78 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.3 pt -84.88 -6.08 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 178.503 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.554 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -61.32 -46.43 94.44 Favored Glycine 0 C--N 1.337 0.622 0 C-N-CA 120.729 -0.748 . . . . 0.0 111.763 -179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.1 pttp -45.09 -17.18 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.123 0.487 . . . . 0.0 110.373 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.495 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -97.12 -44.23 2.85 Favored Glycine 0 C--N 1.336 0.532 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.771 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.513 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.8 m -107.24 -42.41 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 CA-C-O 120.615 0.245 . . . . 0.0 110.649 179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.554 ' N ' ' O ' ' A' ' 12' ' ' GLY . 34.5 tptt -66.18 -41.37 90.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.001 179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.7 tt -40.2 -23.73 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 C-N-CA 120.782 -0.367 . . . . 0.0 111.886 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.545 HG23 ' N ' ' A' ' 19' ' ' GLY . 10.3 tp -158.7 -46.48 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.718 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.545 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 70.86 60.2 4.7 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.93 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 172.15 -71.14 0.11 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.823 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.41 -55.42 31.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.261 179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.99 -17.37 62.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.296 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.5 tt -79.47 55.23 1.89 Allowed 'General case' 0 N--CA 1.463 0.213 0 CA-C-O 121.288 0.566 . . . . 0.0 109.614 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -162.24 -47.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.825 -179.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER 54.53 82.92 0.09 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.641 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.557 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.33 -0.283 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.092 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 36.9 ptt180 -172.41 160.47 4.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.819 0.342 . . . . 0.0 110.618 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.433 ' C ' ' H ' ' A' ' 5' ' ' ARG . 66.4 mtm180 -145.13 -78.66 0.19 Allowed 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.243 -179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -75.59 14.79 0.57 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.442 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.433 ' H ' ' C ' ' A' ' 3' ' ' ARG . 3.9 tpt180 54.1 68.52 0.84 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.571 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 82.6 mttt 51.61 89.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.529 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 32.3 t-105 -168.86 -14.83 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.58 HD12 ' N ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -77.81 -16.35 58.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.812 179.193 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.58 ' N ' HD12 ' A' ' 8' ' ' LEU . 30.5 mmt180 53.57 64.67 1.76 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.661 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 11.8 ptm180 -95.3 -47.27 6.39 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.033 0.444 . . . . 0.0 110.68 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.481 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 9.4 tp -129.95 -21.97 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.513 -0.445 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.503 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.11 -36.17 73.31 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 114.807 -1.088 . . . . 0.0 110.748 178.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -52.91 -18.91 2.19 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.17 0.51 . . . . 0.0 109.828 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -94.26 -36.57 5.65 Favored Glycine 0 C--N 1.33 0.221 0 CA-C-N 115.548 -0.751 . . . . 0.0 112.24 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.45 HG23 ' N ' ' A' ' 16' ' ' LYS . 21.4 m -118.97 -45.77 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 -179.203 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.503 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.9 tttm -49.35 -47.53 47.31 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.164 -179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.565 HG23 ' N ' ' A' ' 18' ' ' ILE . 10.1 tp -70.7 -48.27 59.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.313 -179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.565 ' N ' HG23 ' A' ' 17' ' ' ILE . 37.2 mt -136.02 89.71 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.557 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.443 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . 155.22 -18.0 0.53 Allowed Glycine 0 C--N 1.331 0.262 0 N-CA-C 111.554 -0.618 . . . . 0.0 111.554 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.92 -9.82 0.35 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.202 -0.523 . . . . 0.0 112.057 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . 56.82 19.32 4.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.908 0.385 . . . . 0.0 110.452 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.69 -33.3 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.133 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 23.7 mt -83.15 26.46 0.63 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.239 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -164.43 -43.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.51 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 54.29 87.3 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.53 ' N ' HD12 ' A' ' 26' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.072 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -77.44 44.91 0.45 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.83 0.348 . . . . 0.0 110.742 -179.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.0 ttp180 -54.14 -27.93 36.65 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.658 179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -149.84 51.47 0.92 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.189 -179.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' A' ' 7' ' ' TRP . 24.6 ttt-85 61.07 137.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.328 -179.861 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -48.72 88.78 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.627 -179.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.496 ' N ' ' O ' ' A' ' 5' ' ' ARG . 47.6 t90 -167.19 -9.24 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.846 -179.735 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.533 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.7 -74.74 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 121.034 -0.267 . . . . 0.0 110.444 -179.807 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 mmm-85 176.04 20.72 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -48.36 -88.5 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 120.822 -0.351 . . . . 0.0 110.15 179.747 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -84.13 -17.87 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.543 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.31 -43.33 64.85 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -45.7 -18.85 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.016 0.436 . . . . 0.0 110.391 179.209 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.9 -42.26 3.61 Favored Glycine 0 C--N 1.332 0.351 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.071 179.936 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -107.87 -44.38 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 116.653 0.227 . . . . 0.0 110.855 -179.742 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' A' ' 12' ' ' GLY . 60.1 tttm -58.86 -27.0 64.74 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.725 179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.425 ' O ' HG23 ' A' ' 17' ' ' ILE . 3.2 tp -70.49 25.69 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 CA-C-O 120.951 0.405 . . . . 0.0 110.779 179.919 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.533 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.6 mt 61.85 94.14 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.115 0 CA-C-O 120.869 0.366 . . . . 0.0 110.348 179.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 170.52 1.76 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.742 179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.85 -32.78 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.201 -0.523 . . . . 0.0 111.964 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.42 -42.31 62.21 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.869 0.366 . . . . 0.0 110.484 179.89 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.48 -17.21 60.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.504 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.508 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.3 mm? -68.27 1.51 2.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.108 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.404 ' O ' ' O ' ' A' ' 25' ' ' HIS . 36.5 t70 -164.83 -56.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.686 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.47 ' ND1' ' N ' ' A' ' 26' ' ' LEU . 66.7 t-80 57.88 157.1 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.532 -179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.47 ' N ' ' ND1' ' A' ' 25' ' ' HIS . 14.9 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.472 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -78.51 43.72 0.49 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.909 0.385 . . . . 0.0 110.659 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.7 ttp180 -68.3 -36.69 79.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.565 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -161.75 71.25 0.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.156 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.501 ' O ' ' N ' ' A' ' 7' ' ' TRP . 7.3 tpm_? 61.66 131.77 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.309 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -54.75 82.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.065 -179.562 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.511 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 70.2 t90 -173.26 13.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.628 179.829 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.742 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -70.8 -37.6 73.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.924 -179.156 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.88 22.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.968 -0.293 . . . . 0.0 110.23 -179.666 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -51.78 -88.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.7 tp -82.98 -21.11 9.16 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.051 179.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.47 -37.14 59.68 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.933 -0.867 . . . . 0.0 110.933 179.445 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.7 ttpp -46.53 -18.27 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 0.0 110.409 179.001 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.27 -44.14 1.91 Allowed Glycine 0 C--N 1.334 0.464 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.503 -179.659 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.6 m -103.43 -39.96 6.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.717 0 CA-C-N 116.889 0.345 . . . . 0.0 111.161 -179.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 61.1 tttp -68.57 -32.44 72.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.684 0.278 . . . . 0.0 110.894 -179.892 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.1 tt -44.96 -26.41 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.924 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 32.3 mt -135.27 -78.84 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 179.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 163.45 -2.79 0.06 OUTLIER Glycine 0 C--N 1.33 0.237 0 C-N-CA 121.262 -0.494 . . . . 0.0 111.969 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 76.21 -5.43 42.63 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 121.203 -0.522 . . . . 0.0 111.978 -179.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.43 19.28 0.26 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.802 0.334 . . . . 0.0 110.527 -179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -160.87 -46.89 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.362 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.0 tp -78.23 58.71 2.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.362 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -170.16 -16.95 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.499 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.6 t-80 -77.74 62.3 2.59 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.687 -179.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.2 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.545 179.883 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.354 0 N-CA-C 111.991 -0.444 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 3' ' ' ARG . 46.5 ttt85 -170.66 -18.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.773 0.321 . . . . 0.0 110.483 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 2' ' ' ARG . 82.7 mtm180 -53.19 -23.99 9.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.732 -179.919 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 39.5 mttp -146.04 47.24 1.24 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.399 -179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.8 mtm180 51.34 -99.66 0.08 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.375 -179.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.7 mtmm -138.54 77.19 1.61 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 116.29 -0.414 . . . . 0.0 109.952 179.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 88.0 t90 -163.96 5.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.039 -0.528 . . . . 0.0 109.95 -179.922 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.444 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -85.61 6.05 29.08 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.861 179.892 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 mmt85 54.13 55.48 8.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.893 179.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 5.0 ptm180 -54.2 -50.16 67.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.109 0.48 . . . . 0.0 109.944 179.66 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.465 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 15.7 tt -126.66 -18.45 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.836 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.442 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -56.34 -31.07 59.28 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 110.547 -1.021 . . . . 0.0 110.547 178.782 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.9 ttpp -53.59 -11.59 0.38 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.163 0.506 . . . . 0.0 109.813 178.93 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -108.43 -46.29 1.0 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.487 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.46 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.9 m -97.47 -39.35 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 CA-C-N 117.005 0.402 . . . . 0.0 111.607 -179.329 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -73.93 -33.82 64.1 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 120.539 -0.465 . . . . 0.0 110.588 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.471 HG23 ' N ' ' A' ' 18' ' ' ILE . 17.3 tt -45.97 -40.22 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.442 -179.586 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.506 HG23 ' O ' ' A' ' 18' ' ' ILE . 12.1 tt -160.82 33.52 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 121.395 0.617 . . . . 0.0 110.672 -179.717 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -149.25 18.85 1.19 Allowed Glycine 0 C--N 1.331 0.277 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 179.626 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -163.64 -50.39 0.02 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.89 -80.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.782 0.325 . . . . 0.0 110.26 179.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.55 -27.0 67.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.15 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.9 tp -76.61 64.14 2.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.306 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.427 ' C ' ' H ' ' A' ' 26' ' ' LEU . 17.6 t70 -170.76 -25.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.603 -179.985 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.456 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 1.1 m-70 -76.82 33.64 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.728 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.427 ' H ' ' C ' ' A' ' 24' ' ' ASP . 13.2 mt . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.512 179.868 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 111.96 -0.456 . . . . 0.0 111.96 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.465 ' NH1' ' O ' ' A' ' 2' ' ' ARG . 2.9 ptm180 -53.39 85.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.981 0.419 . . . . 0.0 110.432 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.497 ' N ' ' O ' ' A' ' 1' ' ' GLY . 44.7 mtp85 -53.63 -48.96 68.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.65 -179.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt -161.59 63.75 0.26 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.897 0.38 . . . . 0.0 110.484 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER 53.44 -103.29 0.16 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.061 179.809 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -96.35 178.37 5.39 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.645 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 47.0 m95 58.28 20.31 7.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.982 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.575 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.87 -61.76 1.95 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.041 0.448 . . . . 0.0 109.864 179.824 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -167.18 15.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.444 179.844 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -48.12 -87.36 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.02 179.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.2 pt -84.49 -18.08 9.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.842 0.353 . . . . 0.0 110.085 179.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.496 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.32 -38.46 68.79 Favored Glycine 0 N--CA 1.45 -0.368 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -49.58 -15.72 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.165 0.507 . . . . 0.0 109.892 179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.441 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.62 -45.8 1.9 Allowed Glycine 0 C--N 1.336 0.539 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.329 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -101.19 -41.45 8.62 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 CA-C-N 117.032 0.416 . . . . 0.0 111.063 -179.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 12' ' ' GLY . 9.1 tmtm? -59.19 -36.99 76.33 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.9 tt -63.82 -0.38 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.097 179.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.459 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.9 mt 63.15 94.56 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.241 -179.847 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -175.39 1.14 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.755 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -67.93 162.77 48.26 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.236 -0.507 . . . . 0.0 111.906 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.93 -54.68 18.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.847 0.356 . . . . 0.0 110.493 179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.435 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -76.94 -33.43 57.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.419 179.809 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.2 mm? -77.85 36.0 0.21 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.899 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' A' ' 22' ' ' ALA . 22.3 t0 -167.37 -71.15 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.4 ' O ' ' O ' ' A' ' 24' ' ' ASP . 45.0 t60 53.49 103.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.511 179.988 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.563 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.5 mp . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.11 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.401 ' O ' ' O ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.401 ' O ' ' O ' ' A' ' 1' ' ' GLY . 84.2 mtt180 60.4 134.35 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.976 0.417 . . . . 0.0 110.764 179.98 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -171.38 -50.16 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.19 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -93.38 26.45 2.96 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.215 179.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.5 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 9.8 mpt_? 53.7 58.02 5.53 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.159 -179.824 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.9 mttt 51.65 79.6 0.1 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.412 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.474 ' CD2' ' O ' ' A' ' 7' ' ' TRP . 83.5 t90 -160.33 6.3 0.08 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.139 -179.912 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.419 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -83.77 24.41 0.89 Allowed 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.686 179.816 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 10.1 mmt85 58.69 39.3 24.58 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.847 179.593 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -52.58 -92.9 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 178.772 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.6 tt -80.85 -15.25 12.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.502 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.455 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -57.03 -39.53 89.79 Favored Glycine 0 C--N 1.335 0.503 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 179.495 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -51.5 -12.73 0.18 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.071 0.463 . . . . 0.0 109.821 178.846 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -106.28 -41.52 1.76 Allowed Glycine 0 C--N 1.338 0.64 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.783 -179.685 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.52 -38.24 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 CA-C-N 117.314 0.557 . . . . 0.0 111.01 -179.299 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 12' ' ' GLY . 6.1 tmtt? -59.29 -61.26 2.76 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 -179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.582 ' O ' HG22 ' A' ' 18' ' ' ILE . 17.2 tt -51.82 -34.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.385 -179.991 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.657 HG23 ' O ' ' A' ' 18' ' ' ILE . 17.2 tt 126.23 107.53 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 O-C-N 124.888 1.368 . . . . 0.0 110.077 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -91.86 70.56 1.81 Allowed Glycine 0 C--N 1.334 0.436 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 179.8 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -46.3 -39.37 9.68 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 121.332 -0.461 . . . . 0.0 112.342 -179.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.0 -55.57 11.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.817 0.341 . . . . 0.0 110.56 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.91 -50.27 50.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.309 179.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.4 mt -76.59 67.83 2.79 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.424 179.879 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.8 t0 -171.58 -23.62 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.452 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 -73.45 -37.17 65.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.683 179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.9 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.453 179.905 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.262 0 N-CA-C 111.992 -0.443 . . . . 0.0 111.992 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.6 ptp85 -172.26 49.34 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.799 0.333 . . . . 0.0 110.484 -179.938 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 20.5 mmt180 -71.67 -31.31 66.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 mttt -143.32 25.65 1.69 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.275 179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.4 ttm180 74.08 -65.19 0.36 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.23 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 79.2 mttt -146.78 166.69 25.89 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.357 179.78 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 23.7 m95 63.35 15.69 8.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.316 179.589 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.571 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.47 -70.45 0.09 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-O 120.854 0.359 . . . . 0.0 110.332 -179.912 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.47 15.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.08 179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.7 ptm180 -42.63 -89.14 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.194 179.586 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -77.12 -20.29 14.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 179.427 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.6 -42.08 90.13 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 111.032 -0.827 . . . . 0.0 111.032 179.516 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -48.02 -15.46 0.07 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.968 0.414 . . . . 0.0 110.071 178.695 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.444 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.82 -41.71 2.83 Favored Glycine 0 C--N 1.337 0.592 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.403 -179.969 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.9 m -105.96 -42.96 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 116.961 0.381 . . . . 0.0 110.679 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.1 tttp -56.41 -38.67 71.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.833 0.349 . . . . 0.0 110.381 179.72 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.8 tt -64.27 0.35 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.514 179.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.7 mt 61.67 66.46 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.166 -179.796 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -69.25 -176.75 14.52 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 121.229 -0.51 . . . . 0.0 112.149 -179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.31 -34.96 86.99 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 121.26 -0.495 . . . . 0.0 111.979 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -54.14 49.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.49 179.97 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.77 -21.37 66.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.426 179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.5 tp -67.61 -5.06 13.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.248 -179.927 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.495 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 34.2 t70 -160.73 13.32 0.11 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.686 -179.99 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.495 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 34.5 p-80 40.9 27.04 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.2 179.995 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.9 tp . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.357 179.999 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.374 0 N-CA-C 112.018 -0.433 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.7 ttm-85 60.39 47.8 8.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.165 179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 16.1 tpt180 -77.86 -27.48 49.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.417 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 55.0 tttm -164.8 63.85 0.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.366 -179.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.7 mmt85 52.42 -106.06 0.26 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.323 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 96.1 mttt -141.63 70.66 1.34 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.817 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.496 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.0 m-90 -160.05 3.51 0.08 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.315 -179.712 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.567 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -64.38 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 179.82 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.26 19.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.828 179.419 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -39.21 -90.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.7 tt -83.3 -17.18 10.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 179.177 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.95 -42.8 81.59 Favored Glycine 0 N--CA 1.451 -0.364 0 N-CA-C 111.596 -0.602 . . . . 0.0 111.596 179.558 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -47.93 -15.88 0.07 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.961 0.41 . . . . 0.0 110.234 179.206 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.62 -40.44 2.36 Favored Glycine 0 C--N 1.336 0.533 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.543 -179.847 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -107.24 -40.6 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-N 116.935 0.367 . . . . 0.0 110.981 -179.364 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 12' ' ' GLY . 34.9 ttpt -56.67 -60.48 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.694 -0.402 . . . . 0.0 110.481 -179.845 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -73.94 10.91 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 121.122 0.487 . . . . 0.0 109.986 179.94 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.432 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.0 mt 57.4 87.08 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.437 179.994 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.33 93.22 1.1 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.328 -0.463 . . . . 0.0 111.998 179.922 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.421 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -60.61 -10.66 18.83 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.153 -0.546 . . . . 0.0 111.854 179.966 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -73.23 10.71 0.9 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.781 0.324 . . . . 0.0 110.46 179.995 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -163.79 -47.46 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.453 -179.926 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.1 tt -76.64 39.62 0.22 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.914 179.846 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 22' ' ' ALA . 18.7 t70 -170.22 1.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.741 -179.839 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 79.3 t60 -54.67 -14.45 1.35 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.454 179.996 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 pp . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.66 -179.899 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 111.916 -0.474 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.9 ptt180 -79.11 25.43 0.29 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.744 0.306 . . . . 0.0 110.477 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.405 ' H ' ' C ' ' A' ' 1' ' ' GLY . 36.6 ttm180 -60.25 -26.44 66.44 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.595 179.964 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' O ' ' O ' ' A' ' 5' ' ' ARG . 56.0 tttm -161.55 44.25 0.16 Allowed 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.863 -179.955 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' TRP . 15.2 tpp180 60.6 137.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.22 -179.596 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.84 88.0 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.082 0.468 . . . . 0.0 110.26 -179.89 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.513 ' N ' ' O ' ' A' ' 5' ' ' ARG . 64.6 t-105 -170.96 -20.35 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.403 -179.788 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.63 77.65 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.889 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 7' ' ' TRP . 23.8 mmt180 45.71 25.67 0.29 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.443 179.068 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -45.93 -88.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.3 pt -86.71 -14.56 10.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 178.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.38 -37.87 83.85 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 -179.921 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -52.57 -13.69 0.41 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.906 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.443 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.83 -44.8 2.38 Favored Glycine 0 C--N 1.334 0.438 0 CA-C-N 115.452 -0.795 . . . . 0.0 112.162 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.7 m -106.64 -42.83 6.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 CA-C-N 116.914 0.357 . . . . 0.0 111.239 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.0 tptm -53.99 -42.07 68.62 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.433 -179.589 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.552 HG23 ' H ' ' A' ' 18' ' ' ILE . 2.2 tp -50.43 -56.02 4.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.488 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.636 HG23 ' O ' ' A' ' 18' ' ' ILE . 13.4 tt -174.02 107.54 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.167 0 CA-C-O 121.208 0.528 . . . . 0.0 110.431 178.723 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.6 77.28 2.12 Favored Glycine 0 C--N 1.331 0.296 0 N-CA-C 111.725 -0.55 . . . . 0.0 111.725 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -44.98 -39.39 6.4 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.353 -179.705 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.92 -49.96 58.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.803 0.335 . . . . 0.0 110.686 -179.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.4 -47.7 19.15 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.772 -179.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.9 tt -77.6 60.6 2.18 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.028 -179.762 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -171.87 9.09 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.46 179.917 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -48.34 151.58 1.03 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.746 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.41 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.319 -179.869 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.435 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.232 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 -61.46 81.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.792 0.33 . . . . 0.0 110.482 179.954 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.435 ' N ' ' O ' ' A' ' 1' ' ' GLY . 60.4 ttm-85 -75.2 -27.94 59.78 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.666 179.969 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -145.8 50.37 1.19 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.478 -179.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 54.1 mtp180 50.69 -94.85 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.716 179.764 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.0 mttp -144.33 88.12 1.92 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.475 -179.839 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.41 ' H ' ' H ' ' A' ' 8' ' ' LEU . 42.7 t90 -171.37 -6.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.454 179.992 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.577 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.9 -74.99 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.218 -179.714 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -173.97 19.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.557 -179.977 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.76 -89.37 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.141 179.696 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.4 pt -84.48 -13.23 11.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.229 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.509 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.67 -45.18 85.88 Favored Glycine 0 N--CA 1.449 -0.462 0 N-CA-C 111.532 -0.627 . . . . 0.0 111.532 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -49.95 -15.33 0.19 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.793 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . -101.53 -43.66 2.11 Favored Glycine 0 C--N 1.336 0.549 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.361 179.998 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 4.0 p -103.54 -40.83 6.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 CA-C-N 117.09 0.445 . . . . 0.0 110.978 -179.589 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 12' ' ' GLY . 10.9 ttmm -51.85 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.678 -0.409 . . . . 0.0 110.354 179.901 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 28.7 pt -73.56 12.45 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 C-N-CA 120.733 -0.387 . . . . 0.0 110.594 -179.978 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.42 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.7 mt 59.98 100.63 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.378 179.994 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -74.1 91.48 0.72 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.135 -0.555 . . . . 0.0 111.869 179.911 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -45.06 -19.11 0.17 Allowed Glycine 0 C--N 1.33 0.224 0 C-N-CA 121.282 -0.485 . . . . 0.0 112.294 -179.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.407 ' N ' ' C ' ' A' ' 19' ' ' GLY . . . -53.48 -74.01 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.799 0.333 . . . . 0.0 110.394 179.99 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -81.45 -37.69 27.62 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.564 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.513 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.0 mm? -73.89 69.62 1.41 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.14 -179.962 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.6 t0 -171.08 -34.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.504 179.905 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -65.7 -71.56 0.19 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.525 179.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.523 HD22 ' N ' ' A' ' 26' ' ' LEU . 2.5 mm? . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.008 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.318 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -60.44 125.45 23.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.789 0.328 . . . . 0.0 110.533 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -73.76 -52.5 12.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.677 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 mttm -140.66 25.23 2.19 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.122 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.4 ' O ' ' N ' ' A' ' 7' ' ' TRP . 83.8 mtm180 54.01 -175.16 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.162 -179.611 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.2 mtmp? -65.79 76.76 0.08 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.414 179.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.406 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 56.5 t-105 -170.69 -5.4 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.729 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.537 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -45.69 -73.07 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.418 -179.865 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -175.74 18.82 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.195 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -41.93 -89.53 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.264 179.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.3 pt -87.87 -11.5 10.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 179.226 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.05 -45.73 80.56 Favored Glycine 0 N--CA 1.451 -0.355 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.811 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -45.42 -17.91 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.02 0.438 . . . . 0.0 110.243 178.836 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.466 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.75 -41.66 3.54 Favored Glycine 0 C--N 1.335 0.514 0 CA-C-N 115.78 -0.645 . . . . 0.0 112.249 179.813 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -108.33 -44.08 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-N 116.777 0.289 . . . . 0.0 111.023 -179.654 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 12' ' ' GLY . 16.6 ttpp -53.36 -37.68 62.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.77 0.319 . . . . 0.0 110.634 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.5 tt -71.37 14.81 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.664 -179.73 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.467 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.5 mt 60.23 108.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.85 0.357 . . . . 0.0 110.485 179.977 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.09 1.53 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.289 0 N-CA-C 111.82 -0.512 . . . . 0.0 111.82 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.408 ' H ' ' H ' ' A' ' 21' ' ' ALA . . . -175.4 2.96 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.942 -179.938 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.408 ' H ' ' H ' ' A' ' 20' ' ' GLY . . . -72.12 -78.73 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.886 0.374 . . . . 0.0 110.497 -179.975 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.24 -26.33 63.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.456 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.509 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.5 mm? -79.9 36.76 0.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.129 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -168.88 -23.78 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.699 -179.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 59.6 t60 54.19 63.57 2.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.405 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.413 -179.956 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.379 0 N-CA-C 111.964 -0.455 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.4 mmt-85 -76.74 63.37 2.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.74 0.305 . . . . 0.0 110.492 -179.947 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -75.49 -34.96 60.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.548 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.512 ' O ' ' N ' ' A' ' 6' ' ' LYS . 75.4 mttt -145.65 30.07 1.11 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.361 179.948 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.2 mmt85 57.45 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.683 -179.93 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 4' ' ' LYS . 81.9 mttt -145.69 75.98 1.45 Allowed 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.871 0.367 . . . . 0.0 110.179 179.888 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 70.9 t-105 -166.09 7.87 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.58 -179.805 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.565 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.52 -89.91 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.825 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.7 tpp180 -169.51 27.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.544 179.959 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -50.65 -89.82 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.315 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.7 pt -84.03 -16.35 10.88 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.042 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.505 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.56 -41.43 64.57 Favored Glycine 0 N--CA 1.45 -0.372 0 N-CA-C 110.912 -0.875 . . . . 0.0 110.912 179.622 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 5.4 ttpm? -44.13 -19.35 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.01 0.433 . . . . 0.0 110.207 178.81 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -100.88 -44.23 2.11 Favored Glycine 0 C--N 1.335 0.511 0 CA-C-N 115.925 -0.58 . . . . 0.0 112.493 -179.734 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.3 m -104.25 -40.53 6.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 CA-C-N 116.974 0.387 . . . . 0.0 111.282 -179.4 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.8 tttt -69.52 -33.48 72.89 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.827 -0.349 . . . . 0.0 110.883 -179.724 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.8 tt -48.1 -26.14 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.541 179.997 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 25.3 mt -135.25 -78.17 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 179.468 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 155.94 32.02 0.03 OUTLIER Glycine 0 C--N 1.333 0.38 0 N-CA-C 111.754 -0.539 . . . . 0.0 111.754 179.884 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 64.49 2.38 7.35 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.954 -0.641 . . . . 0.0 111.737 -179.772 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -77.65 25.77 0.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.831 0.348 . . . . 0.0 110.547 -179.935 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.41 -43.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.467 -179.961 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.4 tp -78.08 45.75 0.55 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.276 179.932 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -169.63 -40.75 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.557 -179.957 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 60.1 133.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.787 179.846 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.555 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.8 mp . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.11 179.974 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.382 0 N-CA-C 111.888 -0.485 . . . . 0.0 111.888 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.471 ' O ' ' N ' ' A' ' 4' ' ' LYS . 42.1 mtp85 -69.85 -69.42 0.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.669 0.271 . . . . 0.0 110.58 -179.952 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 22.9 mmm-85 60.63 -76.46 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.81 179.989 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 2' ' ' ARG . 78.2 tttt -154.11 51.14 0.66 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.972 0.415 . . . . 0.0 110.161 179.971 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 47.36 40.43 10.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.581 -179.854 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 54.7 84.0 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.484 -179.997 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.469 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 77.0 t-105 -171.24 8.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.521 -179.99 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.568 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.23 -70.49 0.09 Allowed 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.228 -179.907 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.75 14.82 0.14 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 179.767 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -45.88 -87.77 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.242 179.719 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.0 mm -84.88 -18.96 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 179.736 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.25 -40.12 83.62 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.565 -0.826 . . . . 0.0 111.064 179.558 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -49.44 -16.22 0.19 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.189 0.518 . . . . 0.0 109.864 178.813 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.35 -45.98 1.91 Allowed Glycine 0 C--N 1.333 0.407 0 CA-C-N 115.5 -0.773 . . . . 0.0 112.182 179.844 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.9 m -102.2 -41.05 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 CA-C-N 116.873 0.336 . . . . 0.0 111.301 -179.559 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.8 tttp -57.38 -41.72 80.78 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.729 -179.697 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.8 tt -68.3 4.62 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-O 121.01 0.433 . . . . 0.0 110.163 179.908 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.442 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.9 mt 61.3 101.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.36 -179.767 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.28 -75.78 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.833 179.986 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -68.9 -29.18 72.55 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.14 -0.553 . . . . 0.0 111.814 179.837 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.67 -61.6 2.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.869 0.366 . . . . 0.0 110.296 179.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.17 72.35 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.251 179.756 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.3 tt -79.12 41.86 0.46 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.915 179.822 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.485 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 8.9 t70 -167.3 -19.13 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.42 -179.923 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.485 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 34.9 p-80 40.71 93.01 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.252 179.922 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.8 mt . . . . . 0 C--N 1.33 -0.255 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.473 179.855 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 111.942 -0.463 . . . . 0.0 111.942 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -168.13 22.17 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.824 0.345 . . . . 0.0 110.507 -179.985 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.8 mmp_? -51.7 -22.55 3.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.488 179.863 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.4 pttt -159.51 63.9 0.38 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.248 -179.975 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 89.5 mtt180 52.49 -171.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.328 -179.864 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.539 ' CD ' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -75.6 95.03 3.28 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 179.784 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.428 ' C ' ' H ' ' A' ' 9' ' ' ARG . 59.8 t-105 -161.91 -14.13 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.541 -179.99 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.636 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -67.62 4.1 1.18 Allowed 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.146 -179.864 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 7' ' ' TRP . 31.0 mmt180 59.58 32.95 21.91 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.08 -179.873 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HE ' HG12 ' A' ' 11' ' ' ILE . 1.8 ptm180 -48.36 -91.55 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 179.318 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.425 HG12 ' HE ' ' A' ' 10' ' ' ARG . 9.5 pt -95.66 -7.2 9.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.747 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.2 -35.55 88.22 Favored Glycine 0 N--CA 1.449 -0.48 0 N-CA-C 110.991 -0.844 . . . . 0.0 110.991 179.644 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -53.44 -14.59 0.82 Allowed 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.07 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.419 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.63 -43.23 2.53 Favored Glycine 0 C--N 1.335 0.476 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.303 -179.816 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' N ' ' A' ' 16' ' ' LYS . 21.6 m -108.74 -41.13 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.591 0 CA-C-N 116.86 0.33 . . . . 0.0 111.29 -179.475 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.8 ttpt -62.32 -31.71 72.36 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.372 -179.722 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.1 tt -62.76 -1.59 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.057 0.456 . . . . 0.0 110.084 179.497 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.45 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.6 mt 64.26 69.52 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.461 0.122 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.341 -179.844 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -77.63 -16.07 80.62 Favored Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.905 179.878 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 75.57 -11.61 9.51 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.277 -0.487 . . . . 0.0 111.992 -179.975 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.24 17.73 0.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.776 0.322 . . . . 0.0 110.405 179.873 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.15 -49.36 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.28 -179.994 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.8 mt -79.51 66.65 5.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.41 179.854 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -170.46 -26.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.602 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -61.87 -77.39 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.729 -179.943 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.133 -179.883 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 mtt-85 -67.63 85.53 0.19 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.781 0.324 . . . . 0.0 110.562 -179.947 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 50.23 -113.44 0.66 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.59 179.963 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.505 ' O ' ' N ' ' A' ' 6' ' ' LYS . 46.1 mttm -80.65 36.59 0.39 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.727 0.299 . . . . 0.0 110.508 179.947 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 54.05 -84.63 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.476 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.505 ' N ' ' O ' ' A' ' 4' ' ' LYS . 85.2 mttt -143.13 82.41 1.75 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.262 179.967 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 62.1 t-105 -162.65 -0.67 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.506 -179.974 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.623 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -62.51 -90.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.62 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.29 23.18 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.502 179.607 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.6 ptm180 -45.46 -90.29 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.022 179.522 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.0 tp -76.06 -19.02 15.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 179.255 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.519 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.18 -42.25 95.18 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.001 -0.839 . . . . 0.0 111.001 179.232 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -46.33 -17.98 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.077 0.465 . . . . 0.0 110.243 179.005 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.467 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.13 -40.76 3.66 Favored Glycine 0 C--N 1.335 0.481 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.198 179.996 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.6 m -109.56 -44.21 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 CA-C-N 116.771 0.285 . . . . 0.0 111.196 -179.62 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.519 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.6 ttmt -51.5 -41.74 61.21 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.719 -179.75 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 6.0 pt -39.81 -39.29 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-N 116.637 -0.256 . . . . 0.0 111.14 -179.86 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.568 HG23 ' N ' ' A' ' 19' ' ' GLY . 16.8 tt -171.82 -47.16 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.781 179.656 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.568 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 154.96 37.85 0.02 OUTLIER Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.899 -0.48 . . . . 0.0 111.899 179.976 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.17 -139.72 21.45 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.402 -0.428 . . . . 0.0 112.112 179.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.74 94.34 9.09 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.57 0.224 . . . . 0.0 111.152 -179.277 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.422 ' C ' ' N ' ' A' ' 24' ' ' ASP . . . 57.87 62.22 2.15 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 -178.83 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.507 HD12 ' N ' ' A' ' 23' ' ' LEU . 8.9 mp 56.32 15.65 2.04 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 -177.16 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.422 ' N ' ' C ' ' A' ' 22' ' ' ALA . 20.3 t70 49.57 43.21 23.9 Favored 'General case' 0 CA--C 1.521 -0.146 0 CA-C-O 122.264 1.03 . . . . 0.0 108.949 -179.111 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -79.34 112.31 16.44 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 113.561 -1.654 . . . . 0.0 110.385 -179.651 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.519 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.9 mp . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.119 179.897 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.242 0 N-CA-C 111.985 -0.446 . . . . 0.0 111.985 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 49.9 mtm180 -70.29 2.05 4.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.804 0.335 . . . . 0.0 110.633 180.0 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.4 mtp180 -49.69 -28.58 6.18 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -148.39 154.78 40.38 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.22 179.975 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.9 mtp85 -60.27 -76.12 0.05 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.944 0.402 . . . . 0.0 110.522 179.958 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 48.8 mtmt -136.24 61.34 1.65 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.093 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 97.5 m95 -159.34 4.76 0.09 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.331 -179.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.482 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -51.93 -90.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.439 -179.701 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.455 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 2.5 mmt-85 -147.41 16.52 1.16 Allowed 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.593 -0.276 . . . . 0.0 110.301 -179.688 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.448 ' CZ ' ' O ' ' A' ' 6' ' ' LYS . 5.8 ptt180 -49.27 -86.63 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.553 -0.459 . . . . 0.0 109.764 179.849 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 tt -95.55 -14.5 7.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.233 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.506 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.93 -38.34 74.31 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.652 179.673 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -51.5 -18.7 1.16 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.25 0.548 . . . . 0.0 109.587 179.034 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.417 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.7 -43.4 3.38 Favored Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.532 -179.77 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.7 m -107.54 -42.53 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 CA-C-N 116.997 0.399 . . . . 0.0 111.299 -179.469 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.506 ' N ' ' O ' ' A' ' 12' ' ' GLY . 1.6 ttpm? -58.01 -34.37 69.94 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.759 -0.377 . . . . 0.0 110.4 -179.953 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.2 tt -64.34 0.29 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 121.118 0.485 . . . . 0.0 109.93 179.519 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.464 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 63.19 96.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.503 -179.991 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.93 6.72 0.08 OUTLIER Glycine 0 C--N 1.331 0.288 0 N-CA-C 111.712 -0.555 . . . . 0.0 111.712 179.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.448 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . 179.67 -139.69 3.94 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 121.148 -0.549 . . . . 0.0 111.748 -179.966 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.33 -90.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.743 0.306 . . . . 0.0 110.537 179.935 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.448 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -69.56 -41.4 75.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.481 179.981 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.1 tp -78.91 66.38 4.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.325 179.961 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.427 ' C ' ' H ' ' A' ' 26' ' ' LEU . 12.7 t70 -167.31 -4.89 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.444 -179.987 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.404 ' H ' ' H ' ' A' ' 24' ' ' ASP . 9.2 p-80 -71.67 9.18 0.91 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.689 -179.851 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.54 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.128 179.852 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.258 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -166.76 51.57 0.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.795 0.331 . . . . 0.0 110.553 -179.971 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -60.07 -55.97 27.34 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.478 179.945 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -82.89 37.05 0.52 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.594 179.963 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 41.2 mtt-85 52.42 -92.6 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.641 179.886 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 87.6 mttt -146.97 46.67 1.17 Allowed 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.191 -179.949 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 84.7 t90 -122.48 -3.44 8.86 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.602 179.707 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.35 14.58 0.92 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.181 179.626 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.8 mmt180 62.83 42.94 7.39 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.352 179.326 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -52.51 -91.91 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 178.79 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.3 pp -89.35 -4.58 10.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.755 178.823 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.552 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -65.67 -38.39 94.51 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 111.143 -0.783 . . . . 0.0 111.143 179.618 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.3 tmmm? -51.4 -16.79 0.62 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 179.037 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.81 -39.78 4.28 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.378 -179.941 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.9 m -114.19 -41.72 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 120.795 0.331 . . . . 0.0 111.207 -179.461 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.552 ' N ' ' O ' ' A' ' 12' ' ' GLY . 79.4 tttt -66.42 -26.47 67.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.139 -179.722 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.0 tp -40.95 -42.14 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.339 0 CA-C-N 116.76 -0.2 . . . . 0.0 111.278 -179.537 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.2 tt -170.87 6.63 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-O 120.915 0.388 . . . . 0.0 110.613 179.725 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -46.76 -22.9 1.26 Allowed Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.239 -179.998 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.62 -51.3 3.36 Favored Glycine 0 C--N 1.33 0.209 0 C-N-CA 121.307 -0.473 . . . . 0.0 111.946 -179.912 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.3 -56.67 11.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.852 0.358 . . . . 0.0 110.429 179.868 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' C ' ' N ' ' A' ' 24' ' ' ASP . . . -66.01 -23.48 66.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.298 179.798 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.9 tp -54.26 -11.35 0.48 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.324 179.939 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.41 ' N ' ' C ' ' A' ' 22' ' ' ALA . 29.8 t70 -155.17 8.87 0.29 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.599 -179.95 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.432 ' ND1' ' N ' ' A' ' 25' ' ' HIS . 4.8 m80 52.96 103.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.69 179.826 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.19 -0.459 . . . . 0.0 109.958 179.88 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.911 -0.476 . . . . 0.0 111.911 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 ttp85 -169.67 -1.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.933 0.397 . . . . 0.0 110.365 179.986 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -48.02 -24.42 1.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.504 179.794 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -143.34 159.05 43.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.162 179.755 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 11.3 tpp85 -73.66 72.27 1.45 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.267 -179.998 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mttm 57.03 60.55 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.775 -179.904 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' CD1' ' O ' ' A' ' 5' ' ' ARG . 85.9 m95 -150.5 12.22 0.71 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.504 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.43 59.54 5.24 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.214 -0.903 . . . . 0.0 110.095 179.979 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 40.2 mmm-85 52.96 37.02 23.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.788 179.688 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.1 ptt85 -52.41 -85.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.072 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.4 tt -90.6 -13.46 9.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.162 179.167 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.536 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.71 -42.69 85.77 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.141 179.642 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.37 -17.97 0.33 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 178.786 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.452 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -92.32 -44.03 4.16 Favored Glycine 0 C--N 1.331 0.277 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.716 179.779 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.44 HG23 ' N ' ' A' ' 16' ' ' LYS . 17.5 m -110.15 -46.45 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.67 0.235 . . . . 0.0 110.997 -179.88 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.553 ' C ' ' H ' ' A' ' 18' ' ' ILE . 33.7 ttmt -52.34 -29.19 22.43 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.616 -0.434 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' O ' HG23 ' A' ' 17' ' ' ILE . 3.0 tp -69.85 27.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.808 0.337 . . . . 0.0 110.519 179.232 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.553 ' H ' ' C ' ' A' ' 16' ' ' LYS . 35.4 pt 37.69 48.82 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.019 0.438 . . . . 0.0 111.33 -179.778 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -79.02 38.36 1.98 Allowed Glycine 0 C--N 1.332 0.326 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.929 179.769 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.67 -21.81 1.92 Allowed Glycine 0 C--N 1.33 0.223 0 C-N-CA 121.144 -0.55 . . . . 0.0 111.863 -179.93 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -65.91 -50.97 62.54 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.768 0.318 . . . . 0.0 110.381 179.978 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -36.93 60.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.49 -179.96 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.5 tp -76.89 41.51 0.28 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.392 -179.908 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -170.89 -23.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.567 -179.948 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 51.3 73.02 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.55 179.972 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.426 HD23 ' C ' ' A' ' 26' ' ' LEU . 1.6 tt . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.136 179.99 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.269 0 N-CA-C 111.943 -0.463 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -170.25 113.65 0.46 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.873 0.368 . . . . 0.0 110.247 179.937 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 65.5 mtt85 52.08 -105.87 0.24 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.384 -179.916 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' O ' ' N ' ' A' ' 6' ' ' LYS . 79.1 mttt -80.73 38.71 0.45 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.763 0.316 . . . . 0.0 110.543 179.883 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.488 HH21 ' NZ ' ' A' ' 6' ' ' LYS . 84.4 mtm180 57.29 -78.63 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.011 179.919 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -157.18 74.54 0.78 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.893 0.378 . . . . 0.0 110.209 -179.845 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.429 ' CD2' ' O ' ' A' ' 7' ' ' TRP . 61.4 t90 -167.49 14.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.522 179.836 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.487 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -64.8 -94.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.165 179.844 . . . . . . . . 3 3 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.487 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 63.2 mmt-85 -135.12 11.95 3.58 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.402 -179.772 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -42.25 -87.53 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.633 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.9 tp -80.32 -17.88 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 178.968 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.8 -37.42 84.09 Favored Glycine 0 N--CA 1.45 -0.413 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 179.313 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -52.6 -13.53 0.4 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.176 0.512 . . . . 0.0 109.683 179.209 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.04 -41.22 2.89 Favored Glycine 0 C--N 1.334 0.461 0 CA-C-N 115.67 -0.695 . . . . 0.0 112.125 179.927 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.2 m -107.31 -43.57 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 CA-C-N 116.61 0.205 . . . . 0.0 111.404 -179.423 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . 45.3 mtpt -65.95 -25.18 67.0 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.505 -179.882 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.682 HG23 ' H ' ' A' ' 18' ' ' ILE . 13.6 tt -47.38 -60.47 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.932 -179.76 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.682 ' H ' HG23 ' A' ' 17' ' ' ILE . 10.6 tt -171.71 24.04 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.392 0.615 . . . . 0.0 109.703 179.928 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.437 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -40.29 94.77 0.01 OUTLIER Glycine 0 C--N 1.332 0.322 0 CA-C-N 115.761 -0.654 . . . . 0.0 112.475 -179.943 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.409 ' N ' ' O ' ' A' ' 18' ' ' ILE . . . -43.12 -21.11 0.11 Allowed Glycine 0 C--N 1.331 0.271 0 C-N-CA 121.354 -0.45 . . . . 0.0 112.21 179.998 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.437 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -69.98 -52.83 21.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.86 0.362 . . . . 0.0 110.25 179.819 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.19 -43.36 64.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.385 179.806 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.4 tp -50.0 -23.34 1.98 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.433 179.919 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -163.64 64.98 0.17 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.501 179.831 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 29.5 p80 -69.18 159.85 32.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.614 -179.912 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.57 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.112 179.973 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.224 0 N-CA-C 111.916 -0.473 . . . . 0.0 111.916 . . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.424 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 55.3 ttt180 64.68 -1.92 0.73 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.812 0.339 . . . . 0.0 110.514 -179.99 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 1' ' ' GLY . 9.1 tpm_? -51.32 -22.55 2.91 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.117 0.484 . . . . 0.0 109.778 179.683 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -144.46 175.88 9.79 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.793 179.468 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -70.96 -71.41 0.25 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.806 -179.693 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 48.2 mttm -144.89 73.82 1.38 Allowed 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.326 -179.778 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 69.4 t-105 -170.88 6.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.233 -179.97 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.601 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.87 -75.5 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.185 -179.814 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.405 ' N ' ' CD ' ' A' ' 9' ' ' ARG . 0.0 OUTLIER -170.55 14.21 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.292 179.382 . . . . . . . . 3 3 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.1 ptp180 -41.91 -87.09 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 179.48 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.8 tt -79.12 -10.7 12.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 177.934 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.51 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -60.51 -44.2 97.98 Favored Glycine 0 C--N 1.336 0.582 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 179.556 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -46.92 -17.91 0.06 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.092 0.472 . . . . 0.0 109.846 178.54 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.47 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.34 -44.47 2.55 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.498 -179.993 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -103.88 -42.01 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 CA-C-N 117.005 0.403 . . . . 0.0 110.879 -179.566 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 17.4 ttmm -61.94 -32.75 73.2 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.759 0.314 . . . . 0.0 110.443 -179.97 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.526 HG23 ' N ' ' A' ' 18' ' ' ILE . 8.8 tt -60.21 -45.8 95.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.28 179.911 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.526 ' N ' HG23 ' A' ' 17' ' ' ILE . 76.2 mt -138.87 -65.86 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.414 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.34 49.12 7.61 Favored Glycine 0 C--N 1.33 0.236 0 CA-C-N 116.209 -0.451 . . . . 0.0 112.033 -179.967 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . 164.99 168.62 27.43 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 121.343 -0.456 . . . . 0.0 111.984 179.987 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.7 -88.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.707 0.289 . . . . 0.0 110.522 -179.959 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -57.2 -21.75 35.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.306 179.928 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 41.6 tp -55.85 -17.91 7.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.051 179.899 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' C ' ' H ' ' A' ' 26' ' ' LEU . 47.8 t0 -154.28 61.75 0.7 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.514 -179.985 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 2.3 t60 -77.13 34.25 0.16 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.555 179.826 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 24' ' ' ASP . 12.1 mt . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.545 -179.815 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.302 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -57.45 -35.81 70.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.789 0.328 . . . . 0.0 110.542 179.912 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 84.1 mtp180 47.48 -97.13 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.734 -179.992 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' O ' ' O ' ' A' ' 5' ' ' ARG . 62.5 mttt -97.98 36.58 1.53 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.277 179.97 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.527 ' O ' ' N ' ' A' ' 7' ' ' TRP . 77.1 mtp180 56.15 162.05 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -179.187 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' O ' ' CD2' ' A' ' 7' ' ' TRP . 1.4 mptm? -49.0 87.61 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.745 0.307 . . . . 0.0 110.656 -179.408 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.527 ' N ' ' O ' ' A' ' 5' ' ' ARG . 0.4 OUTLIER -172.34 -18.43 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.105 179.839 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.568 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -49.77 -98.1 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.241 179.875 . . . . . . . . 3 3 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ppt_? -172.5 21.83 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.826 -0.349 . . . . 0.0 111.106 -179.861 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.6 ptt85 -43.81 -90.31 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.495 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.5 tt -83.65 -14.45 11.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 178.825 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.2 -42.25 81.42 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 111.536 -0.625 . . . . 0.0 111.536 179.672 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -47.39 -16.57 0.06 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.986 0.422 . . . . 0.0 110.137 179.064 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.9 -42.54 2.43 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.768 -0.651 . . . . 0.0 112.644 -179.844 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -104.91 -41.16 6.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 CA-C-N 117.093 0.446 . . . . 0.0 111.077 -179.456 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 62.1 tttm -54.41 -53.0 59.97 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.78 0.324 . . . . 0.0 110.716 -179.721 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -73.81 13.02 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-O 120.998 0.427 . . . . 0.0 110.211 -179.852 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.424 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.3 mt 59.21 104.96 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.372 -179.907 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.37 139.83 26.36 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.287 -0.482 . . . . 0.0 112.191 -179.813 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.432 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 50.4 15.48 1.19 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.126 179.796 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 49.92 16.2 0.21 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.079 0.466 . . . . 0.0 110.34 -179.786 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.432 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -158.39 -29.53 0.08 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.898 -179.979 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.9 tp -80.16 53.91 1.84 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.968 179.622 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -163.72 -32.23 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.274 -179.62 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -78.92 102.91 8.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.549 179.984 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.1 mp . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.14 179.932 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 111.981 -0.448 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -169.48 89.22 0.18 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.751 0.31 . . . . 0.0 110.542 -179.988 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -97.06 -27.69 14.48 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.72 -179.94 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.517 ' O ' ' N ' ' A' ' 6' ' ' LYS . 57.5 mttt -143.87 45.38 1.47 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.379 -179.729 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 57.74 -78.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.605 -179.819 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 4' ' ' LYS . 76.8 mttt -137.04 -167.19 2.04 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.078 179.736 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.451 ' C ' ' H ' ' A' ' 9' ' ' ARG . 1.1 m-90 72.8 -30.18 0.21 Allowed 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.14 -179.975 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.492 HD23 ' H ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -68.36 9.67 0.31 Allowed 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 121.022 -0.271 . . . . 0.0 111.261 -179.644 . . . . . . . . 3 3 . 1 . 041 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.451 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.4 mmt85 60.24 61.7 1.75 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.714 0.292 . . . . 0.0 111.014 179.426 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 25.1 ptt180 -59.27 -50.12 75.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.253 0.549 . . . . 0.0 109.847 179.402 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.47 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 12.4 tt -124.75 -19.17 3.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 178.872 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 14' ' ' GLY . . . -55.99 -33.59 60.75 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.116 -0.947 . . . . 0.0 111.281 179.276 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -54.21 -11.61 0.51 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.173 0.511 . . . . 0.0 109.747 179.371 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -105.69 -44.04 1.48 Allowed Glycine 0 C--N 1.333 0.362 0 CA-C-N 115.711 -0.677 . . . . 0.0 112.445 -179.765 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.423 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.1 m -102.41 -38.65 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.944 0.372 . . . . 0.0 111.61 -179.207 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.426 ' N ' ' O ' ' A' ' 12' ' ' GLY . 66.8 mttm -73.91 -27.61 61.13 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.732 -179.775 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.407 HG23 ' N ' ' A' ' 18' ' ' ILE . 16.5 tt -43.49 -37.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 121.151 -0.22 . . . . 0.0 111.473 -179.613 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.407 ' N ' HG23 ' A' ' 17' ' ' ILE . 3.1 tp -164.51 17.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 120.922 0.391 . . . . 0.0 110.498 179.979 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -122.92 16.82 8.21 Favored Glycine 0 C--N 1.336 0.544 0 N-CA-C 111.666 -0.574 . . . . 0.0 111.666 179.937 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -167.42 -38.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.145 -0.55 . . . . 0.0 111.825 179.953 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.41 1.8 2.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.888 0.375 . . . . 0.0 110.303 179.899 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -156.21 -43.77 0.08 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.076 179.961 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.5 mm? -79.85 61.21 3.71 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.814 179.769 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 42.0 t0 -162.86 -37.24 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.521 -179.86 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -73.18 -92.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.492 -179.974 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.57 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.7 mp . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.132 -179.932 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.517 ' N ' ' NH1' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.452 -0.263 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.497 HH22 ' NH2' ' A' ' 10' ' ' ARG . 88.5 mtt-85 -147.08 86.5 1.64 Allowed 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.803 0.335 . . . . 0.0 110.405 179.976 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.575 ' NE ' ' H ' ' A' ' 3' ' ' ARG . 0.1 OUTLIER -67.01 -74.0 0.12 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 109.965 179.764 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 mttp -76.17 -82.62 0.07 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.432 179.921 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.438 ' NE ' ' HZ1' ' A' ' 6' ' ' LYS . 19.3 ttt85 -169.54 -71.75 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.339 -0.391 . . . . 0.0 109.952 179.798 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.504 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 38.0 mttp -145.85 55.77 1.19 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.104 179.612 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 8.7 m-90 -160.45 6.02 0.08 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.269 -179.832 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.585 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -71.87 -88.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 -179.982 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -171.03 23.52 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.514 179.563 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.497 ' NH2' HH22 ' A' ' 2' ' ' ARG . 0.3 OUTLIER -43.6 -90.07 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.04 179.658 . . . . . . . . 3 3 . 1 . 042 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.554 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.4 pp -98.19 1.32 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.391 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 179.113 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.554 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -70.11 -32.77 69.24 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 110.52 -1.032 . . . . 0.0 110.52 178.91 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -50.15 -14.91 0.18 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.048 0.451 . . . . 0.0 109.918 178.78 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.446 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -105.55 -45.45 1.32 Allowed Glycine 0 C--N 1.337 0.59 0 CA-C-N 115.736 -0.665 . . . . 0.0 112.521 -179.6 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.504 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.3 m -99.99 -38.31 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-N 117.058 0.429 . . . . 0.0 111.224 -179.344 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.475 ' N ' ' O ' ' A' ' 12' ' ' GLY . 46.9 tttm -66.4 -42.78 87.33 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.911 -0.315 . . . . 0.0 110.895 -179.712 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.5 tt -47.95 -20.45 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.645 -179.687 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 9.5 pt -135.03 2.5 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 179.365 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -91.95 -24.43 25.11 Favored Glycine 0 C--N 1.331 0.258 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 179.825 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.45 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -167.06 -168.01 28.6 Favored Glycine 0 N--CA 1.451 -0.36 0 N-CA-C 111.767 -0.533 . . . . 0.0 111.767 179.914 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.32 11.53 0.26 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 -179.55 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.45 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -169.04 -52.31 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.315 -179.9 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -81.76 57.29 3.34 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.906 0.384 . . . . 0.0 110.443 179.834 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.497 ' O ' ' CG ' ' A' ' 25' ' ' HIS . 34.3 m-20 -162.35 -58.46 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.018 -179.947 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.497 ' CG ' ' O ' ' A' ' 24' ' ' ASP . 57.0 p-80 40.94 28.7 0.06 Allowed 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.223 179.936 . . . . . . . . 2 2 . 1 . 042 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.554 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.107 -179.911 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 10.2 mpt_? -72.71 73.67 1.09 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.876 0.369 . . . . 0.0 110.202 179.926 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 75.4 mtp180 -70.2 -38.29 75.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.596 -179.878 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 31.7 mtpt -145.25 44.6 1.32 Allowed 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.461 -179.918 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 55.22 34.65 23.17 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.499 179.92 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.2 mttt 54.03 80.73 0.11 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.638 179.997 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 25.4 t90 -166.29 10.8 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.111 179.905 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.674 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.7 pt? -75.84 23.87 0.13 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.069 -179.86 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.4 mmt85 62.21 38.59 13.4 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.43 179.912 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.1 ptt180 -46.5 -92.71 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.461 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.521 ' CD1' ' H ' ' A' ' 11' ' ' ILE . 0.0 OUTLIER -85.21 -1.06 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.169 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 178.761 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -69.94 -44.84 60.05 Favored Glycine 0 C--N 1.336 0.566 0 C-N-CA 120.994 -0.622 . . . . 0.0 111.766 -179.894 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -45.54 -17.44 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.268 0.556 . . . . 0.0 110.129 178.938 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -94.78 -45.03 3.24 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.6 -0.727 . . . . 0.0 112.031 -179.935 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.48 ' O ' ' N ' ' A' ' 19' ' ' GLY . 25.8 m -108.83 -40.92 4.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 120.763 0.316 . . . . 0.0 110.564 -179.965 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.556 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.9 tptm -66.1 -41.11 91.06 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.884 179.824 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.0 tt -41.07 -25.02 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.4 -179.616 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.554 HG23 ' N ' ' A' ' 19' ' ' GLY . 15.0 tt -164.83 -48.05 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.899 -0.32 . . . . 0.0 110.942 179.451 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.554 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 164.62 -15.79 0.1 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.024 179.965 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.64 -32.38 1.21 Allowed Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 121.148 -0.549 . . . . 0.0 111.911 -179.946 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.422 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -50.49 -51.97 42.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.834 0.349 . . . . 0.0 110.432 179.864 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.66 -40.12 61.63 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.355 179.861 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.467 HD23 ' O ' ' A' ' 23' ' ' LEU . 0.8 OUTLIER -61.27 -14.59 27.47 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.84 -179.988 . . . . . . . . 3 3 . 1 . 043 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -162.83 62.87 0.2 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.38 -179.994 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -72.87 8.96 1.28 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.65 -179.886 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.3 mt . . . . . 0 C--N 1.33 -0.248 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.329 179.827 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.937 -0.465 . . . . 0.0 111.937 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -75.15 72.3 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.801 0.334 . . . . 0.0 110.458 -179.975 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.5 mmt85 -73.39 -21.2 60.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.341 -179.956 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 6' ' ' LYS . 42.9 mttp -146.02 42.52 1.22 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.118 179.934 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 53.84 -88.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.522 -179.899 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.587 ' NZ ' ' NH2' ' A' ' 10' ' ' ARG . 50.5 mttm -146.38 59.11 1.22 Allowed 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.506 -179.931 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 74.1 t-105 -126.87 -4.66 6.35 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.872 179.649 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -86.61 10.47 15.44 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.142 179.658 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 59.78 48.55 9.02 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.065 179.515 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.587 ' NH2' ' NZ ' ' A' ' 6' ' ' LYS . 1.3 ptp180 -51.38 -76.52 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 178.86 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.1 tt -98.42 -13.71 7.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.424 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.62 -43.81 78.95 Favored Glycine 0 C--N 1.334 0.422 0 C-N-CA 120.799 -0.715 . . . . 0.0 111.459 179.728 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -47.82 -16.83 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.177 0.513 . . . . 0.0 109.998 179.153 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.76 -41.81 3.26 Favored Glycine 0 C--N 1.334 0.47 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.258 179.946 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.1 m -106.05 -44.75 8.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 CA-C-N 117.048 0.424 . . . . 0.0 111.32 -179.534 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 12' ' ' GLY . 32.6 mmtm -58.11 -33.53 69.23 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 120.382 -0.527 . . . . 0.0 109.838 179.926 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.9 tt -61.13 -2.25 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.162 179.498 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.1 mt 64.98 88.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.325 -179.851 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 179.46 29.28 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.967 -179.942 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -176.86 -152.57 9.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.054 -179.921 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.44 -91.05 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.776 0.322 . . . . 0.0 110.233 -179.805 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -74.89 -39.07 61.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.265 179.681 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.595 HD12 ' N ' ' A' ' 23' ' ' LEU . 8.7 mp -78.49 72.33 5.01 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.159 179.998 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -170.45 -24.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.541 -179.965 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.2 m-70 -78.22 47.02 0.65 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.504 -179.955 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.443 179.934 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.222 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.1 ptp85 -166.14 -8.88 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.75 0.31 . . . . 0.0 110.475 179.983 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.46 ' C ' ' H ' ' A' ' 5' ' ' ARG . 17.9 mmm180 -53.73 94.62 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.731 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' N ' ' CD ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER 55.85 6.86 0.23 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.419 -179.527 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 3' ' ' ARG . 12.7 tpt85 -87.59 81.72 7.65 Favored 'General case' 0 N--CA 1.463 0.205 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.404 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt 57.03 55.92 5.7 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.253 -179.45 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 71.4 t-105 -164.29 1.94 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.175 -179.858 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.511 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.14 -79.64 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.465 -179.583 . . . . . . . . 3 3 . 1 . 045 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 mmt85 -151.07 17.96 0.76 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 -179.777 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.3 ptt85 -41.33 -88.97 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.456 -179.815 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.7 tt -82.58 -16.82 11.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.927 -0.398 . . . . 0.0 109.927 179.277 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.532 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.61 -41.26 93.53 Favored Glycine 0 N--CA 1.45 -0.404 0 C-N-CA 120.544 -0.836 . . . . 0.0 111.301 179.659 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -50.75 -18.06 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.456 0.646 . . . . 0.0 109.359 178.717 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.13 -44.3 3.58 Favored Glycine 0 C--N 1.335 0.516 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.456 179.898 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.1 m -104.31 -44.03 8.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 CA-C-N 116.998 0.399 . . . . 0.0 110.869 -179.63 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.532 ' N ' ' O ' ' A' ' 12' ' ' GLY . 76.9 tttt -58.24 -32.54 68.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.792 0.329 . . . . 0.0 110.333 179.84 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.3 tt -61.75 -0.86 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.339 179.73 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.472 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 64.36 79.47 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.132 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.281 -179.931 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -82.83 -2.13 90.64 Favored Glycine 0 C--N 1.332 0.347 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.024 -179.962 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.442 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 175.13 12.01 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.24 -179.991 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 47.85 18.33 0.13 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.156 0.503 . . . . 0.0 110.398 -179.707 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.442 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -156.81 -27.91 0.09 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.252 179.762 . . . . . . . . 2 2 . 1 . 045 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.8 tp -82.74 57.19 3.68 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.459 179.262 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.4 p-10 -145.53 -12.07 0.52 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.577 -179.216 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -81.53 30.1 0.36 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.772 -179.934 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.588 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.069 -179.987 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.021 -0.431 . . . . 0.0 112.021 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -75.22 119.79 19.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.774 0.321 . . . . 0.0 110.524 179.999 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -166.36 -17.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.55 179.909 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -138.9 37.88 2.16 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.328 179.988 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.403 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 0.0 OUTLIER 49.94 44.12 25.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.525 179.903 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 54.9 mttm 55.01 77.42 0.21 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.045 179.614 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 79.1 m95 -162.57 12.52 0.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.986 -0.552 . . . . 0.0 109.699 179.556 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.518 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -59.98 -91.53 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.162 179.974 . . . . . . . . 3 3 . 1 . 046 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.452 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 22.9 mmt180 -143.31 15.38 1.85 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.708 -179.632 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -45.35 -87.0 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.883 179.789 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 pt -93.43 -10.23 9.49 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.839 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.07 -34.25 65.89 Favored Glycine 0 N--CA 1.45 -0.412 0 N-CA-C 111.196 -0.762 . . . . 0.0 111.196 179.756 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.9 ttpp -50.08 -16.41 0.3 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.037 0.446 . . . . 0.0 109.968 179.178 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.433 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.66 -44.36 1.56 Allowed Glycine 0 C--N 1.335 0.488 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.667 -179.707 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 19.9 m -102.65 -37.82 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 CA-C-N 116.971 0.386 . . . . 0.0 111.307 -179.336 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' N ' ' O ' ' A' ' 12' ' ' GLY . 83.7 tttt -71.35 -34.99 70.99 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.811 -0.356 . . . . 0.0 110.9 -179.644 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.2 tt -50.82 -36.66 15.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.457 -179.712 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 46.4 mm -85.79 -64.75 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.434 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 178.616 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 168.44 -12.41 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.397 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.452 -179.997 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.14 -60.55 3.1 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.356 -0.449 . . . . 0.0 112.129 179.907 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.89 -47.14 60.68 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.86 0.362 . . . . 0.0 110.726 -179.877 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.87 -7.23 57.74 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.801 -179.829 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.3 tp -138.2 66.69 1.43 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.898 0.38 . . . . 0.0 110.191 179.89 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 26' ' ' LEU . 28.2 t70 -169.45 -24.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.07 179.965 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -78.46 30.94 0.18 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.672 179.888 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.8 mp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.112 179.988 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.8 mtp85 -77.98 71.07 4.43 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.716 0.294 . . . . 0.0 110.651 180.0 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -74.32 -24.89 59.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.47 -179.945 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.4 tttp -142.41 -88.74 0.14 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.486 179.982 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.6 mtp85 -155.03 -69.79 0.12 Allowed 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 120.741 0.305 . . . . 0.0 110.371 -179.981 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 0.7 OUTLIER -159.17 49.77 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.37 -179.805 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.497 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 93.3 m95 -160.09 11.82 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.765 179.924 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.538 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.08 -69.8 0.12 Allowed 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.122 -179.898 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -166.92 20.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.17 179.913 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -43.0 -89.82 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.755 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.9 pt -89.31 -8.64 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 178.973 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.94 -41.3 96.21 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 179.977 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -48.6 -16.34 0.11 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.114 0.483 . . . . 0.0 110.008 179.105 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.455 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.81 -41.79 2.81 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.738 -0.665 . . . . 0.0 112.488 -179.915 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.2 m -109.0 -41.39 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 116.924 0.362 . . . . 0.0 111.39 -179.284 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . 87.7 tttt -54.38 -53.99 46.64 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.569 -179.592 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.3 tt -70.04 4.54 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-O 121.25 0.548 . . . . 0.0 109.859 179.766 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.8 mt 60.69 70.54 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.294 -179.97 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -70.98 107.23 2.1 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.167 -0.54 . . . . 0.0 112.055 -179.912 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -57.59 -14.58 14.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 121.12 -0.562 . . . . 0.0 111.87 179.872 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.28 13.29 0.59 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.838 0.351 . . . . 0.0 110.465 179.902 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -161.44 -46.31 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.293 179.963 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.49 62.53 3.12 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.231 0.538 . . . . 0.0 109.741 179.872 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -171.87 -53.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.449 -179.795 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -76.84 99.97 5.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.492 179.92 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.554 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.4 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.051 -179.962 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.383 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.1 mmt85 -73.38 84.24 1.45 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.915 0.388 . . . . 0.0 110.655 -179.933 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.424 ' C ' ' H ' ' A' ' 5' ' ' ARG . 57.4 mtp85 52.06 -93.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.912 179.788 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.4 mttt -76.97 27.41 0.14 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.924 -179.597 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.424 ' H ' ' C ' ' A' ' 3' ' ' ARG . 23.4 mmt180 51.01 62.02 2.94 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.566 179.816 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm 52.1 82.3 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.385 -179.893 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.424 ' H ' HD23 ' A' ' 8' ' ' LEU . 28.4 t90 -167.86 8.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.397 -179.94 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.584 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.63 -89.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.751 . . . . . . . . 3 3 . 1 . 048 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -166.92 22.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.817 179.548 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -45.57 -90.05 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.598 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 tt -78.81 -17.14 13.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.009 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.556 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.71 -46.18 83.18 Favored Glycine 0 C--O 1.221 -0.658 0 C-N-CA 120.829 -0.701 . . . . 0.0 111.909 179.977 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' O ' ' CG2' ' A' ' 17' ' ' ILE . 43.1 pttt -47.31 -17.77 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.734 -0.862 . . . . 0.0 109.356 178.486 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.5 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -86.21 -52.08 3.35 Favored Glycine 0 C--N 1.335 0.525 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.819 179.415 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 p -92.38 -43.07 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 179.35 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.556 ' N ' ' O ' ' A' ' 12' ' ' GLY . 77.7 tttt -53.4 -48.58 68.55 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.462 179.006 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.427 ' CG2' ' O ' ' A' ' 13' ' ' LYS . 9.0 tt -65.15 4.42 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 119.77 -0.772 . . . . 0.0 110.218 179.849 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.51 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.4 mt 63.78 91.62 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.345 -179.749 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -157.37 -47.02 0.01 OUTLIER Glycine 0 C--N 1.333 0.364 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.945 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -81.2 -44.43 8.08 Favored Glycine 0 C--N 1.33 0.242 0 N-CA-C 111.856 -0.498 . . . . 0.0 111.856 179.847 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -44.65 -58.82 2.81 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.85 0.357 . . . . 0.0 110.992 -179.874 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.09 -45.04 82.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.481 -179.943 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 44.5 mt -85.91 48.32 1.58 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.693 -179.971 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -167.32 -38.32 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.41 179.714 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 21.2 t-80 -61.3 -77.02 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.397 179.728 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.577 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.2 mp . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.351 179.807 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 55.7 ttp180 -76.17 65.19 2.11 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.779 0.323 . . . . 0.0 110.424 179.951 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.7 mtt-85 -77.36 -24.16 50.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.595 -179.956 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 77.2 tttt -169.94 50.96 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 -179.916 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.1 mtm180 44.12 -155.24 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.888 -179.87 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.518 ' C ' ' HE ' ' A' ' 10' ' ' ARG . 64.3 mmtt -80.34 78.74 7.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.245 179.591 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.455 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 63.7 t-105 -171.55 3.18 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.383 -179.831 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.582 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -55.18 -84.59 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.185 -179.523 . . . . . . . . 3 3 . 1 . 049 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.8 mmm-85 -143.64 17.21 1.82 Allowed 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 110.556 -0.164 . . . . 0.0 110.556 -179.806 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.518 ' HE ' ' C ' ' A' ' 6' ' ' LYS . 4.6 ptt180 -47.95 -86.63 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.965 179.942 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.1 mm -89.85 -12.05 9.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.285 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.47 -39.33 90.49 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 111.361 -0.695 . . . . 0.0 111.361 179.561 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -53.13 -13.0 0.42 Allowed 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 178.841 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.454 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.51 -44.44 1.69 Allowed Glycine 0 C--N 1.335 0.52 0 CA-C-N 115.492 -0.776 . . . . 0.0 112.143 179.899 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.6 m -102.79 -40.52 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 116.887 0.343 . . . . 0.0 111.311 -179.576 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 10.0 ttmm -55.88 -51.78 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.5 -179.83 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.7 tt -67.4 5.7 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.394 -179.856 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.467 ' H ' ' C ' ' A' ' 16' ' ' LYS . 17.7 mt 61.36 88.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.338 179.944 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -76.4 89.52 0.92 Allowed Glycine 0 N--CA 1.452 -0.295 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.958 179.94 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.441 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -56.91 -160.1 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.044 -0.598 . . . . 0.0 111.807 -179.97 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.97 12.5 0.2 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.907 0.384 . . . . 0.0 110.359 -179.92 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.441 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -170.36 -57.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.264 -179.935 . . . . . . . . 2 2 . 1 . 049 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.7 tp -85.83 49.73 1.83 Allowed 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.329 179.847 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -167.24 -53.57 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.482 -179.857 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 2.9 t60 52.77 97.3 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.544 179.974 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 18.3 mt . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.47 179.856 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.253 0 N-CA-C 111.947 -0.461 . . . . 0.0 111.947 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -61.66 92.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.815 0.341 . . . . 0.0 110.659 -179.968 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 59.9 mtm180 -61.01 -29.44 69.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.229 179.745 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.5 ptmm? -167.93 59.16 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.315 -179.891 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 59.7 mtt85 59.19 -163.97 0.22 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.353 -179.728 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -80.64 87.88 5.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.822 -179.607 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.47 ' C ' ' H ' ' A' ' 9' ' ' ARG . 45.2 t-105 -166.8 0.65 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.246 179.832 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.746 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.9 pt? -73.4 29.75 0.07 Allowed 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.402 -179.768 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.47 ' H ' ' C ' ' A' ' 7' ' ' TRP . 41.1 mmm-85 62.85 40.58 9.55 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.854 0.359 . . . . 0.0 110.568 179.835 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -52.2 -89.22 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.718 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.0 tt -76.15 -22.27 15.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 178.587 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.462 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.27 -43.46 75.18 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 179.565 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -46.02 -17.67 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.094 0.474 . . . . 0.0 110.146 178.947 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.461 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.11 -44.25 2.64 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.36 179.971 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.3 m -102.65 -43.67 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 117.155 0.478 . . . . 0.0 111.299 -179.544 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 12' ' ' GLY . 19.4 mmtp -61.02 -31.87 71.49 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.379 -0.528 . . . . 0.0 109.991 179.868 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 5.5 tp -65.48 -0.62 0.82 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 179.451 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.431 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.3 mt 62.65 78.17 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.345 -179.722 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 172.12 47.29 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.796 179.976 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -166.59 -67.71 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.249 -0.501 . . . . 0.0 111.94 -179.921 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.76 -56.09 24.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.786 0.327 . . . . 0.0 110.36 179.92 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.26 -22.46 63.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.283 179.823 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.2 tp -73.66 -25.9 60.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.211 179.925 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -160.65 68.08 0.34 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.376 179.984 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 19.7 p-80 -58.27 153.96 14.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.564 -179.846 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.561 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.759 -179.937 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 0 0 . 1 . 051 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 65.3 mtm180 51.13 70.17 0.56 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.802 0.334 . . . . 0.0 110.583 -180.0 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.692 ' HE ' HH22 ' A' ' 9' ' ' ARG . 67.2 ttp85 -58.93 -29.47 67.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.536 -179.982 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -165.81 70.87 0.14 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.655 179.862 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 51.16 -108.74 0.38 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.922 179.708 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 97.4 mttt -146.04 72.48 1.3 Allowed 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.731 0.301 . . . . 0.0 110.49 -179.794 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 4.1 m-90 -162.22 9.51 0.07 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.87 179.815 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -78.01 -89.73 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.747 179.831 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.692 HH22 ' HE ' ' A' ' 3' ' ' ARG . 0.0 OUTLIER -171.73 23.16 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.583 179.818 . . . . . . . . 3 3 . 1 . 051 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.5 ptp180 -44.26 -90.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.134 179.618 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.8 mm -81.7 -14.73 12.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.395 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.511 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.81 -41.96 96.28 Favored Glycine 0 N--CA 1.449 -0.441 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.443 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.4 ttpt -50.77 -15.07 0.24 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.308 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.461 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.65 -45.81 1.89 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-N 115.503 -0.772 . . . . 0.0 112.229 179.931 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -101.68 -41.42 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-N 116.993 0.397 . . . . 0.0 110.998 -179.683 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.511 ' N ' ' O ' ' A' ' 12' ' ' GLY . 80.5 tttt -57.65 -40.25 78.86 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.759 0.314 . . . . 0.0 110.374 179.941 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.2 tp -67.34 2.41 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.071 0.462 . . . . 0.0 110.093 179.973 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.428 ' H ' ' C ' ' A' ' 16' ' ' LYS . 14.6 mt 60.33 72.27 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.41 -179.891 . . . . . . . . 2 2 . 1 . 051 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.41 11.41 9.26 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.263 -0.494 . . . . 0.0 112.05 -179.969 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.9 -39.31 1.57 Allowed Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 121.27 -0.49 . . . . 0.0 112.012 179.948 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.89 -46.44 87.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.85 0.357 . . . . 0.0 110.468 -179.939 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.02 -26.17 63.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.409 179.931 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.8 tp -77.06 40.98 0.27 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.4 -179.902 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -167.62 -28.07 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.677 -179.891 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 83.2 t60 55.34 90.0 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.519 179.991 . . . . . . . . 1 1 . 1 . 051 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.582 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.118 -179.982 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 052 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 mmt-85 -71.53 75.54 0.79 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.763 0.316 . . . . 0.0 110.519 179.971 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 53.5 ttp85 -68.61 -15.7 63.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.321 179.842 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -155.5 -89.94 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.391 179.99 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -171.97 71.97 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.818 0.342 . . . . 0.0 110.39 179.985 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.0 mttt 52.61 61.51 3.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.435 -179.954 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.48 ' O ' ' CE3' ' A' ' 7' ' ' TRP . 77.5 t90 -162.74 -10.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.961 179.928 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.754 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -63.18 3.63 0.26 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.482 -179.841 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.452 ' H ' ' C ' ' A' ' 7' ' ' TRP . 19.0 mmt180 62.11 40.05 12.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.723 0.297 . . . . 0.0 110.774 179.982 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 ptp180 -50.56 -92.69 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.174 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.546 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.4 pp -93.02 1.97 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.834 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.546 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -71.3 -37.38 63.15 Favored Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.702 -0.959 . . . . 0.0 110.702 179.27 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -51.17 -15.61 0.38 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 178.73 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -97.35 -41.92 3.33 Favored Glycine 0 C--N 1.334 0.433 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.434 -179.779 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.6 m -110.95 -41.57 4.42 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 CA-C-N 116.872 0.336 . . . . 0.0 111.096 -179.472 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 36.7 ttmt -59.45 -32.65 70.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.588 -179.889 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.8 tp -70.45 7.33 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-O 120.915 0.388 . . . . 0.0 110.129 179.882 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.441 ' H ' ' C ' ' A' ' 16' ' ' LYS . 18.6 mt 59.3 93.66 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.131 -179.651 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.12 -2.29 0.04 OUTLIER Glycine 0 C--N 1.33 0.22 0 C-N-CA 121.281 -0.485 . . . . 0.0 111.9 -179.98 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -172.42 173.72 45.4 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 121.154 -0.546 . . . . 0.0 111.822 179.916 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.52 10.69 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.893 0.378 . . . . 0.0 110.267 -179.803 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.445 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -169.54 0.89 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.398 -179.96 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.424 ' H ' ' H ' ' A' ' 22' ' ' ALA . 7.3 tp -153.38 49.18 0.69 Allowed 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.384 179.923 . . . . . . . . 2 2 . 1 . 052 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -171.54 10.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.528 179.959 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -62.55 140.18 58.63 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.665 -179.881 . . . . . . . . 1 1 . 1 . 052 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.505 ' N ' ' CD2' ' A' ' 26' ' ' LEU . 2.1 mm? . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.095 179.982 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.334 0 N-CA-C 111.998 -0.441 . . . . 0.0 111.998 . . . . . . . . . 0 0 . 1 . 053 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.653 ' NE ' ' H ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER 52.24 98.44 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.806 0.336 . . . . 0.0 110.181 -179.954 . . . . . . . . 3 3 . 1 . 053 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 91.7 mtt-85 -61.17 -24.34 66.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.633 -179.978 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -167.31 50.66 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.393 -179.885 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 69.3 -153.53 0.14 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.905 -179.902 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.49 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 52.4 mmtt -88.14 66.67 8.61 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 120.791 0.329 . . . . 0.0 110.679 179.944 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 85.9 m95 -155.83 6.15 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.854 179.705 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.585 ' H ' ' CD2' ' A' ' 8' ' ' LEU . 1.5 pt? -74.79 18.34 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.96 -179.94 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 7' ' ' TRP . 14.6 mmt85 63.19 42.33 7.21 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.022 179.752 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -52.67 -91.46 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 178.648 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 tt -82.1 -16.14 11.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.47 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.09 -40.37 82.85 Favored Glycine 0 C--N 1.335 0.475 0 C-N-CA 120.719 -0.753 . . . . 0.0 111.552 179.767 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -49.2 -15.71 0.13 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.064 0.459 . . . . 0.0 110.001 179.058 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.458 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.02 -43.53 2.21 Favored Glycine 0 C--N 1.336 0.569 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.516 -179.903 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.9 m -104.05 -40.93 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 CA-C-N 117.051 0.425 . . . . 0.0 111.041 -179.639 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.501 ' N ' ' O ' ' A' ' 12' ' ' GLY . 17.6 tptp -59.98 -40.45 89.17 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.976 -0.29 . . . . 0.0 110.563 -179.839 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.429 HG23 ' N ' ' A' ' 18' ' ' ILE . 16.3 tt -53.94 -38.86 38.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.285 179.901 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.429 ' N ' HG23 ' A' ' 17' ' ' ILE . 12.7 mt -75.94 -69.63 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.186 179.629 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.427 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -176.97 50.74 0.11 Allowed Glycine 0 N--CA 1.451 -0.346 0 N-CA-C 111.514 -0.634 . . . . 0.0 111.514 -179.991 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.09 -22.24 0.11 Allowed Glycine 0 C--N 1.331 0.294 0 C-N-CA 121.536 -0.364 . . . . 0.0 112.474 -179.793 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.427 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -55.8 -68.74 0.18 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.819 0.343 . . . . 0.0 110.182 179.855 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.26 -42.87 22.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.32 179.873 . . . . . . . . 1 1 . 1 . 053 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.39 75.89 1.9 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.228 0.537 . . . . 0.0 109.714 179.952 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' A' ' 25' ' ' HIS . 38.4 p-10 -173.34 -29.49 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.945 -179.763 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.43 ' N ' ' OD1' ' A' ' 24' ' ' ASP . 84.5 t60 -56.78 103.2 0.1 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.523 179.939 . . . . . . . . 2 2 . 1 . 053 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.8 mt . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.323 -179.956 . . . . . . . . 0 0 . 1 . 054 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' O ' ' N ' ' A' ' 4' ' ' LYS . 65.7 mtt-85 58.68 -77.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.654 0.264 . . . . 0.0 110.878 179.92 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 1' ' ' GLY . 98.7 mtt180 54.26 -88.3 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.471 -0.332 . . . . 0.0 110.558 -179.966 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.509 ' O ' ' N ' ' A' ' 6' ' ' LYS . 12.1 mptt -76.71 17.17 0.43 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.263 179.933 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.414 ' H ' ' C ' ' A' ' 3' ' ' ARG . 76.2 mtm180 58.2 -78.01 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.717 -179.838 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.9 mttm -145.32 65.05 1.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.784 0.326 . . . . 0.0 110.519 -179.907 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.476 ' H ' HD23 ' A' ' 8' ' ' LEU . 54.1 t-105 -171.0 21.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.384 179.793 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.531 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -74.9 -89.32 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.09 179.95 . . . . . . . . 3 3 . 1 . 054 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 -153.57 16.86 0.53 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.886 -179.872 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.567 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 4.7 ptm180 -46.37 -62.49 1.33 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.258 -179.789 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.567 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 10.7 tp -113.57 -16.68 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.254 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 179.556 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.53 -31.42 57.31 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 178.625 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -53.93 -27.24 29.66 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.312 0.577 . . . . 0.0 109.703 179.136 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -89.9 -30.2 13.62 Favored Glycine 0 N--CA 1.452 -0.29 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.493 -179.571 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.506 ' O ' ' N ' ' A' ' 19' ' ' GLY . 20.4 m -124.4 -48.57 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.934 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.285 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 54.6 tttm -48.66 -52.06 25.2 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.174 -179.095 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.473 HG23 ' N ' ' A' ' 18' ' ' ILE . 14.8 tt -68.68 -42.36 83.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.37 -0.532 . . . . 0.0 110.142 179.717 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.473 ' N ' HG23 ' A' ' 17' ' ' ILE . 26.4 mt -134.67 84.19 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.92 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.506 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 154.49 -8.86 0.39 Allowed Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.448 -0.661 . . . . 0.0 111.448 -179.553 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -159.41 -134.79 1.74 Allowed Glycine 0 C--N 1.332 0.322 0 N-CA-C 111.809 -0.517 . . . . 0.0 111.809 -179.988 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.83 -106.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 121.094 -0.242 . . . . 0.0 110.388 -179.9 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.4 -40.34 93.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.935 0.398 . . . . 0.0 110.171 179.685 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.557 HD12 ' N ' ' A' ' 23' ' ' LEU . 9.3 mp -82.94 68.69 9.54 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.983 179.786 . . . . . . . . 2 2 . 1 . 054 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -167.65 -40.47 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.651 -179.94 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -70.64 -82.87 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.587 -179.838 . . . . . . . . 1 1 . 1 . 054 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.57 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.5 mp . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.292 0 N-CA-C 111.98 -0.448 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 055 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.735 ' H ' ' HE ' ' A' ' 2' ' ' ARG . 0.2 OUTLIER -82.79 -176.3 6.22 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 179.967 . . . . . . . . 3 3 . 1 . 055 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 55.9 -80.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.693 -179.97 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 2' ' ' ARG . 56.2 tttp -149.55 59.79 1.01 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.918 0.39 . . . . 0.0 110.085 179.87 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.7 mtt-85 53.05 -109.94 0.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.772 179.955 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -146.1 74.23 1.36 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.815 0.34 . . . . 0.0 110.455 -179.918 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.417 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 73.5 t-105 -167.92 2.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.475 179.966 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.514 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -58.53 -91.54 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.075 179.751 . . . . . . . . 3 3 . 1 . 055 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.462 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 28.3 mmt180 -139.49 13.08 2.55 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.662 -179.81 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.93 -87.61 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 110.119 -0.326 . . . . 0.0 110.119 179.447 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.4 ' H ' HG13 ' A' ' 11' ' ' ILE . 2.5 pp -89.96 -9.28 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 179.34 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.33 -42.22 88.55 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 179.546 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -51.86 -13.78 0.31 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.949 0.404 . . . . 0.0 109.989 179.435 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.0 -31.62 5.3 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.409 -179.681 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.414 HG23 ' N ' ' A' ' 16' ' ' LYS . 21.1 m -122.03 -41.51 1.67 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 CA-C-N 116.771 0.286 . . . . 0.0 111.328 -179.371 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' A' ' 12' ' ' GLY . 63.5 tttm -55.39 -52.08 64.73 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.934 -179.669 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.481 HG23 ' N ' ' A' ' 18' ' ' ILE . 18.9 tt -58.48 -42.33 84.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.719 -179.677 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.481 ' N ' HG23 ' A' ' 17' ' ' ILE . 6.6 mt -73.91 -20.06 17.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-O 121.049 0.452 . . . . 0.0 110.174 179.757 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.27 -14.79 0.95 Allowed Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 121.225 -0.512 . . . . 0.0 112.061 -179.946 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.09 -45.61 2.3 Favored Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.754 -0.538 . . . . 0.0 111.754 -179.873 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.88 -39.89 66.11 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.908 0.385 . . . . 0.0 109.986 179.649 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.75 -49.06 15.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.993 179.515 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.5 tp -80.27 62.3 4.37 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.262 179.724 . . . . . . . . 1 1 . 1 . 055 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.408 ' H ' ' H ' ' A' ' 25' ' ' HIS . 40.4 t0 -165.52 -0.22 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.678 179.976 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' ASP . 2.6 t60 -73.63 112.2 9.5 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.506 -179.987 . . . . . . . . 2 2 . 1 . 055 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.531 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.4 mp . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.097 179.984 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 111.946 -0.462 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 056 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.797 HH22 ' HZ3' ' A' ' 6' ' ' LYS . 46.3 mtt-85 -75.06 81.26 2.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.764 0.316 . . . . 0.0 110.606 179.964 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -63.15 -36.43 83.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.628 -179.916 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -171.17 67.01 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.577 179.981 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 29.3 mmm-85 53.95 175.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.385 179.99 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.797 ' HZ3' HH22 ' A' ' 2' ' ' ARG . 62.2 mmtt -58.95 91.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.551 -179.981 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.447 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 76.1 t-105 -171.1 4.78 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.696 179.866 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.563 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -72.41 -94.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.838 . . . . . . . . 3 3 . 1 . 056 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.95 25.8 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.554 -179.914 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptp180 -44.36 -90.9 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.513 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.9 pt -81.12 -15.25 12.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 178.627 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.522 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.2 -38.94 91.54 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 110.362 -1.095 . . . . 0.0 110.362 179.472 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.0 ttpp -45.68 -20.56 0.08 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.154 0.502 . . . . 0.0 109.979 178.525 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.07 -46.05 2.71 Favored Glycine 0 C--N 1.336 0.555 0 CA-C-N 115.555 -0.748 . . . . 0.0 112.48 -179.875 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -101.58 -42.89 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 CA-C-N 116.948 0.374 . . . . 0.0 111.04 -179.568 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.522 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.3 tttp -58.16 -35.74 71.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.715 0.293 . . . . 0.0 110.608 179.965 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.37 0.76 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-O 121.017 0.437 . . . . 0.0 110.393 179.998 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.1 mt 62.84 76.3 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.469 179.897 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.42 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -85.64 34.95 3.25 Favored Glycine 0 C--N 1.332 0.322 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.941 179.94 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.2 -35.1 1.1 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 121.25 -0.5 . . . . 0.0 111.879 -179.938 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.42 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -58.31 -52.65 64.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.776 0.322 . . . . 0.0 110.435 179.989 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.75 -31.41 71.59 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.342 179.79 . . . . . . . . 1 1 . 1 . 056 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.64 72.39 1.02 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 121.229 0.538 . . . . 0.0 109.63 179.818 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' H ' ' H ' ' A' ' 25' ' ' HIS . 29.7 t70 -172.23 -9.61 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.057 -179.728 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.431 ' H ' ' H ' ' A' ' 24' ' ' ASP . 39.6 p-80 -49.13 134.39 17.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.733 -179.893 . . . . . . . . 2 2 . 1 . 056 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.5 mt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.476 179.923 . . . . . . . . 0 0 . 1 . 057 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 111.97 -0.452 . . . . 0.0 111.97 . . . . . . . . . 0 0 . 1 . 057 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -73.2 111.71 8.57 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.808 0.337 . . . . 0.0 110.449 -179.991 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -71.2 -58.11 3.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.597 -179.916 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 24.4 mttm -141.21 36.38 1.71 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.165 -179.928 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.1 mtp85 53.57 -164.38 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.058 -179.599 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -78.75 69.85 4.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.463 179.838 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.423 ' HE1' ' NZ ' ' A' ' 16' ' ' LYS . 50.5 t-105 -167.06 6.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.841 -179.854 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.548 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.02 -80.11 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.524 -0.307 . . . . 0.0 110.339 -179.903 . . . . . . . . 3 3 . 1 . 057 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 8.5 mmt85 -147.67 14.84 1.09 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 179.965 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -46.34 -87.34 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.135 179.679 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 17.5 tt -82.67 -20.24 9.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.054 179.423 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.46 ' C ' ' N ' ' A' ' 14' ' ' GLY . . . -53.55 -39.33 60.13 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 111.056 -0.818 . . . . 0.0 111.056 179.353 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -45.27 -19.37 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.096 0.474 . . . . 0.0 110.292 178.974 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.2 -44.98 2.1 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.605 -0.725 . . . . 0.0 112.758 -179.545 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.5 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.4 m -99.57 -40.62 8.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 CA-C-N 117.395 0.598 . . . . 0.0 111.676 -179.223 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.433 ' N ' ' O ' ' A' ' 12' ' ' GLY . 25.0 mmtm -64.1 -39.68 94.58 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.484 -0.486 . . . . 0.0 110.507 -179.928 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.402 HG23 HG22 ' A' ' 18' ' ' ILE . 4.7 tp -48.81 -34.52 6.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.885 -179.597 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.694 HG23 ' O ' ' A' ' 18' ' ' ILE . 5.3 tp -165.35 58.08 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 121.329 0.585 . . . . 0.0 110.54 179.963 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.5 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -169.5 -10.69 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.994 179.963 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -45.36 166.78 0.04 OUTLIER Glycine 0 CA--C 1.519 0.289 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.239 -179.961 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.45 16.91 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.815 0.341 . . . . 0.0 110.686 -179.915 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -159.94 -33.46 0.06 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.134 179.946 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.8 mt -76.37 15.99 0.53 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.239 179.824 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.417 ' H ' ' C ' ' A' ' 22' ' ' ALA . 39.2 t70 -161.06 1.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.244 -179.983 . . . . . . . . 2 2 . 1 . 057 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 57.5 m-70 52.63 26.83 4.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.593 -179.967 . . . . . . . . 1 1 . 1 . 057 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 9.4 tp . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.491 179.953 . . . . . . . . 0 0 . 1 . 058 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.351 0 N-CA-C 111.991 -0.443 . . . . 0.0 111.991 . . . . . . . . . 0 0 . 1 . 058 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 -148.19 -10.81 0.37 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.811 0.339 . . . . 0.0 110.236 179.989 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.9 ptm85 -61.24 -38.05 85.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.563 -179.821 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.485 ' O ' ' N ' ' A' ' 6' ' ' LYS . 53.8 mttp -84.85 34.11 0.54 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.778 0.323 . . . . 0.0 110.267 179.661 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.5 mtt-85 53.41 -86.23 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.612 -179.986 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 4' ' ' LYS . 88.1 mttt -145.56 62.42 1.27 Allowed 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.031 179.992 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.533 ' H ' HD13 ' A' ' 8' ' ' LEU . 95.3 m95 -155.84 17.3 0.37 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.63 -179.81 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.033 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -75.06 33.13 0.1 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.834 179.804 . . . . . . . . 3 3 . 1 . 058 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.453 ' H ' ' C ' ' A' ' 7' ' ' TRP . 12.0 mmt85 65.48 36.77 6.48 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.518 179.748 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.7 ptt85 -51.96 -91.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.147 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -85.43 -17.23 9.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.197 179.572 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.99 -40.29 81.79 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.613 -0.804 . . . . 0.0 111.401 179.714 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -50.03 -14.4 0.15 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.868 0.366 . . . . 0.0 110.096 179.307 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.431 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.33 -37.74 3.23 Favored Glycine 0 C--N 1.334 0.421 0 CA-C-N 115.939 -0.573 . . . . 0.0 112.493 -179.777 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.5 m -111.05 -42.37 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.857 0.329 . . . . 0.0 111.104 -179.486 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.3 tttt -52.89 -51.63 60.51 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.754 -179.709 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.3 pt -42.88 -40.48 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.961 -179.825 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.501 HG23 ' O ' ' A' ' 18' ' ' ILE . 13.3 tt -173.66 86.15 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.559 0.695 . . . . 0.0 109.925 179.786 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 167.85 -18.53 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.444 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 -179.459 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -147.66 -170.93 16.21 Favored Glycine 0 C--N 1.333 0.404 0 N-CA-C 111.775 -0.53 . . . . 0.0 111.775 179.825 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.49 -87.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.759 0.314 . . . . 0.0 110.469 -179.86 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.475 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -64.43 -26.45 68.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.24 179.914 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.3 mm? -83.82 31.71 0.48 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.109 179.902 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.492 ' O ' ' N ' ' A' ' 26' ' ' LEU . 2.9 p30 -163.64 -18.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.599 179.893 . . . . . . . . 2 2 . 1 . 058 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 54.5 t-80 58.59 -77.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.791 179.941 . . . . . . . . 1 1 . 1 . 058 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.492 ' N ' ' O ' ' A' ' 24' ' ' ASP . 37.4 mt . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.722 0.296 . . . . 0.0 110.423 179.99 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 111.891 -0.484 . . . . 0.0 111.891 . . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -76.61 27.33 0.13 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.603 0.24 . . . . 0.0 110.758 -179.973 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.435 ' H ' ' C ' ' A' ' 1' ' ' GLY . 6.4 mmp_? -50.22 -20.7 1.1 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.238 0.542 . . . . 0.0 109.81 179.454 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' NZ ' ' CB ' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -165.57 177.44 7.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.689 179.498 . . . . . . . . 3 3 . 1 . 059 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 73.6 mtm180 -83.54 131.44 34.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.22 0.534 . . . . 0.0 111.635 -179.226 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.1 mttt 43.12 92.66 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.906 178.682 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.402 ' O ' ' O ' ' A' ' 8' ' ' LEU . 68.2 t-105 -174.79 -34.68 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.134 179.129 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.521 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -36.94 -95.77 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.482 -179.748 . . . . . . . . 3 3 . 1 . 059 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.502 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 3.0 tpt180 -167.83 33.59 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.906 0.384 . . . . 0.0 110.567 -179.735 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.84 -90.55 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.913 -0.773 . . . . 0.0 108.913 178.971 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.9 pt -82.8 -13.89 12.04 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.771 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -51.39 -48.85 47.15 Favored Glycine 0 C--N 1.333 0.362 0 N-CA-C 111.346 -0.701 . . . . 0.0 111.346 179.85 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -40.81 -23.55 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.027 0.441 . . . . 0.0 110.436 179.062 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -91.66 -42.63 4.75 Favored Glycine 0 C--N 1.333 0.369 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.425 179.917 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.4 m -107.24 -45.02 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 117.0 0.4 . . . . 0.0 111.122 -179.566 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 60.4 tttm -57.29 -28.73 63.29 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.64 -0.424 . . . . 0.0 110.315 -179.903 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.8 tt -65.41 1.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.973 0.416 . . . . 0.0 110.072 179.592 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 19.2 mt 63.58 92.02 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.151 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.277 -179.916 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -177.25 10.15 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 111.528 -0.629 . . . . 0.0 111.528 -179.986 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -159.51 -43.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.623 -0.591 . . . . 0.0 111.623 179.957 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.83 71.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.85 0.357 . . . . 0.0 110.071 179.649 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.72 -26.06 57.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.308 179.789 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.551 HD12 ' N ' ' A' ' 23' ' ' LEU . 7.9 mp -77.91 44.2 0.46 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.965 179.908 . . . . . . . . 2 2 . 1 . 059 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -161.88 -39.68 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.474 -179.917 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 52.34 99.16 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.473 179.914 . . . . . . . . 1 1 . 1 . 059 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.509 ' N ' ' CD2' ' A' ' 26' ' ' LEU . 2.2 mm? . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.145 -179.932 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.229 0 N-CA-C 111.949 -0.46 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 060 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.4 mmt-85 -76.53 96.32 4.08 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.817 0.342 . . . . 0.0 110.477 179.968 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 50.4 ttt85 -74.04 -75.15 0.16 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.681 -179.927 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -93.11 28.59 2.1 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.749 -179.821 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 31.1 mmt-85 56.26 75.99 0.31 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.634 179.842 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 90.4 mttt 49.08 65.61 1.33 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.842 179.863 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 60.3 t-105 -170.83 15.76 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.45 179.869 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.567 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.85 -70.52 0.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 0.0 109.998 -179.926 . . . . . . . . 3 3 . 1 . 060 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.1 ppt_? -169.27 21.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.132 179.757 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.9 ptp180 -42.63 -90.06 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.53 179.821 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.552 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.2 pp -95.55 0.66 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.54 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.552 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -72.08 -35.8 60.84 Favored Glycine 0 N--CA 1.451 -0.363 0 N-CA-C 111.118 -0.793 . . . . 0.0 111.118 179.393 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -11.41 1.0 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.875 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.57 -40.46 3.17 Favored Glycine 0 C--N 1.334 0.459 0 CA-C-N 115.607 -0.724 . . . . 0.0 112.367 -179.84 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.403 HG23 ' N ' ' A' ' 16' ' ' LYS . 26.4 m -113.4 -39.73 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 CA-C-N 116.775 0.288 . . . . 0.0 111.213 -179.445 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.9 ttpt -71.03 -23.5 62.18 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.041 -179.696 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.518 HG23 ' N ' ' A' ' 18' ' ' ILE . 16.2 tt -56.8 -44.65 82.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.347 -179.387 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.518 ' N ' HG23 ' A' ' 17' ' ' ILE . 3.4 tp -165.09 31.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 120.988 0.423 . . . . 0.0 110.936 -179.845 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -153.13 28.85 0.8 Allowed Glycine 0 C--N 1.331 0.264 0 N-CA-C 111.777 -0.529 . . . . 0.0 111.777 179.926 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.402 ' O ' ' OD1' ' A' ' 24' ' ' ASP . . . -155.74 -52.13 0.01 OUTLIER Glycine 0 C--N 1.331 0.297 0 N-CA-C 111.646 -0.581 . . . . 0.0 111.646 -179.911 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.73 -60.2 3.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.8 0.333 . . . . 0.0 110.669 179.98 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.07 -23.63 24.86 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.997 -179.767 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.6 tp -76.81 62.49 2.05 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.691 -179.602 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.402 ' OD1' ' O ' ' A' ' 20' ' ' GLY . 54.1 m-20 -161.99 -8.1 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.17 179.786 . . . . . . . . 2 2 . 1 . 060 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 29.5 t-80 -70.05 -47.65 61.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.533 179.993 . . . . . . . . 1 1 . 1 . 060 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.524 179.947 . . . . . . . . 0 0 . 1 . 061 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.419 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.453 -0.202 0 N-CA-C 111.87 -0.492 . . . . 0.0 111.87 . . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 81.2 mtm180 -77.21 35.31 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.769 0.318 . . . . 0.0 110.617 -179.929 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 1' ' ' GLY . 68.6 ttt-85 -73.57 -34.73 65.27 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.601 179.938 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.451 ' O ' ' N ' ' A' ' 6' ' ' LYS . 59.1 tttm -169.81 67.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.58 179.974 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.519 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER 48.62 -92.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.4 179.852 . . . . . . . . 3 3 . 1 . 061 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' N ' ' O ' ' A' ' 4' ' ' LYS . 49.5 mtmt -149.25 89.25 1.64 Allowed 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.114 -179.829 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.445 ' C ' ' H ' ' A' ' 9' ' ' ARG . 66.9 t-105 -163.76 -15.18 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.344 -179.935 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.794 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.9 pt? -61.4 1.02 0.23 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.431 -179.982 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.1 mmt85 63.2 38.65 10.38 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.178 179.767 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -54.98 -91.76 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.882 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.7 tt -88.52 -14.05 9.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.175 -0.466 . . . . 0.0 109.854 178.993 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.07 -38.42 66.12 Favored Glycine 0 N--CA 1.448 -0.515 0 N-CA-C 110.672 -0.971 . . . . 0.0 110.672 179.307 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -45.66 -21.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.361 0.6 . . . . 0.0 109.931 178.825 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.441 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.9 -45.19 2.93 Favored Glycine 0 C--N 1.332 0.315 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.598 -179.859 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.0 m -103.18 -41.91 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-N 117.053 0.427 . . . . 0.0 111.694 -179.15 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 12' ' ' GLY . 63.2 tttm -53.06 -56.85 13.02 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.571 -0.452 . . . . 0.0 110.76 -179.495 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.3 tt -66.48 2.21 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.071 0.462 . . . . 0.0 109.97 179.792 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.2 mt 61.03 92.97 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.043 -0.526 . . . . 0.0 109.734 -179.513 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -97.98 111.63 4.28 Favored Glycine 0 C--N 1.334 0.453 0 N-CA-C 111.264 -0.734 . . . . 0.0 111.264 -179.75 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.521 ' O ' ' N ' ' A' ' 24' ' ' ASP . . . 50.68 68.03 1.65 Allowed Glycine 0 C--O 1.225 -0.464 0 N-CA-C 110.838 -0.905 . . . . 0.0 110.838 -179.406 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.417 ' C ' ' H ' ' A' ' 23' ' ' LEU . . . 56.97 22.76 7.55 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.256 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 66.65 0.84 1.97 Allowed 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.93 -178.996 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' A' ' 21' ' ' ALA . 11.0 tp -171.32 62.69 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.672 179.378 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.521 ' N ' ' O ' ' A' ' 20' ' ' GLY . 15.9 t70 -174.58 15.93 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 179.617 . . . . . . . . 2 2 . 1 . 061 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 28.9 p-80 -77.04 7.39 4.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.951 -179.374 . . . . . . . . 1 1 . 1 . 061 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 26' ' ' LEU . 10.0 mp . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.041 179.941 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 062 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.7 ptp180 -174.3 41.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.786 0.327 . . . . 0.0 110.5 -179.909 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 72.1 ttt180 -55.15 -31.12 61.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.599 -179.849 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -162.27 69.62 0.28 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.652 -179.888 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 53.93 -106.66 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.668 179.974 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.512 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 65.3 mttm -148.71 61.85 1.07 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.324 -179.843 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.512 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 95.2 m95 -159.87 17.94 0.16 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.321 -179.904 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.546 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -75.83 -101.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.964 179.987 . . . . . . . . 3 3 . 1 . 062 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.0 mmt180 -133.59 13.84 4.08 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.068 179.94 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.459 ' CG ' ' N ' ' A' ' 11' ' ' ILE . 6.3 ptm85 -58.77 -47.71 83.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.101 0.476 . . . . 0.0 110.202 179.811 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.459 ' N ' ' CG ' ' A' ' 10' ' ' ARG . 1.3 mm -129.52 -20.58 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 N-CA-C 107.479 -1.304 . . . . 0.0 107.479 179.033 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.476 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.25 -33.85 71.87 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.846 -0.901 . . . . 0.0 110.846 179.012 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -52.63 -14.2 0.49 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.051 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -105.72 -46.81 1.16 Allowed Glycine 0 C--N 1.336 0.582 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.442 -179.821 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.479 ' O ' ' N ' ' A' ' 19' ' ' GLY . 4.4 p -98.98 -37.59 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-N 116.974 0.387 . . . . 0.0 110.815 -179.428 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.476 ' N ' ' O ' ' A' ' 12' ' ' GLY . 50.6 tttp -71.13 -31.62 67.96 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.632 -0.427 . . . . 0.0 110.435 179.928 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.6 tt -59.22 -27.21 35.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.689 -179.939 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.451 HG23 ' N ' ' A' ' 19' ' ' GLY . 14.8 tt -163.54 -41.07 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.01 -179.883 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 47.99 64.08 3.21 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.032 -179.805 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -169.11 -70.72 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 179.802 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.78 -41.52 70.65 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.488 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -82.68 -33.38 27.69 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.123 179.578 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.6 tp -77.09 33.6 0.15 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.328 179.88 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.441 ' H ' ' C ' ' A' ' 22' ' ' ALA . 26.4 t0 -171.5 -25.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.501 -179.922 . . . . . . . . 2 2 . 1 . 062 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 72.7 t60 52.84 82.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.429 -179.991 . . . . . . . . 1 1 . 1 . 062 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 16.3 tp . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.188 -179.904 . . . . . . . . 0 0 . 1 . 063 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 111.969 -0.452 . . . . 0.0 111.969 . . . . . . . . . 0 0 . 1 . 063 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.6 mtp180 54.13 29.56 10.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.87 0.367 . . . . 0.0 110.541 179.96 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.4 ttm180 -63.63 -43.72 96.02 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.505 179.974 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.7 pttt -164.13 78.67 0.38 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.249 -179.928 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.2 mtp180 52.01 -178.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.275 -179.807 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -84.56 87.45 7.26 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.38 179.943 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.415 ' H ' ' H ' ' A' ' 8' ' ' LEU . 38.9 t90 -162.1 -4.01 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.873 -179.895 . . . . . . . . 2 2 . 1 . 063 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.574 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -63.94 -90.81 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 179.812 . . . . . . . . 3 3 . 1 . 063 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 tpp180 -171.75 27.52 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.33 -179.908 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -49.16 -89.82 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.588 . . . . . . . . 2 2 . 1 . 063 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.8 mm -81.84 -20.45 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.404 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -54.09 -38.99 62.22 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 179.414 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.6 ttpp -45.64 -31.59 1.98 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.256 0.551 . . . . 0.0 109.81 178.685 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -86.18 -41.5 7.02 Favored Glycine 0 N--CA 1.45 -0.401 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 179.503 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 34.6 t -94.54 -75.19 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 120.424 0.154 . . . . 0.0 110.928 179.856 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.494 ' O ' ' N ' ' A' ' 18' ' ' ILE . 48.9 tttp -33.94 -38.63 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -178.931 . . . . . . . . 2 2 . 1 . 063 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.1 tt -45.42 -13.57 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.573 -179.491 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.494 ' N ' ' O ' ' A' ' 16' ' ' LYS . 18.3 tt -161.54 -32.03 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 121.01 -0.276 . . . . 0.0 111.127 179.983 . . . . . . . . 2 2 . 1 . 063 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 53.51 56.79 18.18 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 121.014 -0.612 . . . . 0.0 111.945 -179.937 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -168.06 -67.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.189 -0.529 . . . . 0.0 111.951 -179.982 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.63 -48.29 49.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.808 0.337 . . . . 0.0 110.413 179.921 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.75 -38.27 23.49 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.249 179.674 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.6 tp -75.68 68.37 2.26 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.417 -179.958 . . . . . . . . 1 1 . 1 . 063 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.482 ' OD1' ' ND1' ' A' ' 25' ' ' HIS . 29.1 p-10 -167.84 -20.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.526 179.959 . . . . . . . . 2 2 . 1 . 063 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.482 ' ND1' ' OD1' ' A' ' 24' ' ' ASP . 0.9 OUTLIER -73.18 114.45 11.37 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.473 179.977 . . . . . . . . 3 3 . 1 . 063 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 12.4 mt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.492 -179.998 . . . . . . . . 0 0 . 1 . 064 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 064 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -57.68 103.01 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.817 0.341 . . . . 0.0 110.519 -179.974 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 9.5 tpt85 -74.1 -36.56 64.25 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.67 -179.816 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.0 mttp -145.51 53.35 1.18 Allowed 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.496 -179.905 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 85.6 mtm180 50.2 -96.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.615 179.968 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 46.0 mttp -145.48 70.62 1.26 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.262 -179.895 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 96.4 m95 -158.86 10.59 0.14 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.335 -179.919 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.568 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.44 -75.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.283 -179.714 . . . . . . . . 3 3 . 1 . 064 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 4.1 mmt180 -159.69 17.72 0.16 Allowed 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.86 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.404 ' HE ' ' HA ' ' A' ' 7' ' ' TRP . 6.6 ptt180 -45.9 -88.12 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.414 179.903 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.7 tt -88.68 -17.77 8.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.407 179.92 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.39 -41.58 55.52 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.992 -0.623 . . . . 0.0 111.732 179.78 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -47.38 -17.17 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.093 0.473 . . . . 0.0 110.256 179.244 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.459 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.33 -43.14 2.6 Favored Glycine 0 C--N 1.333 0.371 0 CA-C-N 115.651 -0.704 . . . . 0.0 112.387 -179.895 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.44 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.6 m -106.08 -41.7 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 CA-C-N 116.872 0.336 . . . . 0.0 111.061 -179.531 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.5 tttm -63.9 -29.87 71.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.707 0.289 . . . . 0.0 110.728 -179.937 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.4 tt -45.78 -22.88 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.091 -179.795 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.551 HG23 ' N ' ' A' ' 19' ' ' GLY . 10.3 tp -158.76 -46.3 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.443 179.864 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.551 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 155.02 6.11 0.09 OUTLIER Glycine 0 C--N 1.333 0.41 0 N-CA-C 111.878 -0.489 . . . . 0.0 111.878 179.975 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 77.26 -13.1 11.01 Favored Glycine 0 N--CA 1.453 -0.209 0 C-N-CA 121.28 -0.486 . . . . 0.0 112.022 -179.851 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.49 -66.52 0.45 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.813 0.34 . . . . 0.0 110.306 179.877 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.41 -45.62 91.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.325 179.794 . . . . . . . . 1 1 . 1 . 064 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.505 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.4 mm? -77.08 -173.17 2.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.001 179.95 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 24' ' ' ASP . 2.9 m-20 55.96 7.72 0.31 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.493 -179.912 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.451 ' H ' ' C ' ' A' ' 23' ' ' LEU . 55.3 t-80 -102.47 98.89 8.91 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.436 179.997 . . . . . . . . 2 2 . 1 . 064 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.7 mt . . . . . 0 C--N 1.33 -0.261 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.502 179.942 . . . . . . . . 0 0 . 1 . 065 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 111.959 -0.456 . . . . 0.0 111.959 . . . . . . . . . 0 0 . 1 . 065 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -55.89 150.84 12.53 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.814 0.34 . . . . 0.0 110.457 179.955 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 44.5 ttt85 -165.12 -24.49 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.683 179.988 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -147.62 20.71 1.17 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.48 -179.99 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 53.87 73.95 0.35 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.505 179.766 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.2 mtmt 48.46 78.61 0.08 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.731 179.817 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 33.5 t-105 -168.72 5.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.667 -179.776 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.871 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -51.89 -74.36 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.684 . . . . . . . . 3 3 . 1 . 065 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.408 ' O ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -171.6 11.96 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.198 179.197 . . . . . . . . 3 3 . 1 . 065 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.408 ' O ' ' O ' ' A' ' 9' ' ' ARG . 0.5 OUTLIER -41.7 -88.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.634 . . . . . . . . 3 3 . 1 . 065 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.6 tt -78.34 -10.85 13.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.724 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.45 -44.27 95.42 Favored Glycine 0 C--N 1.335 0.514 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 179.507 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -46.59 -17.52 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.113 0.482 . . . . 0.0 109.879 178.654 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.78 -45.37 2.69 Favored Glycine 0 C--N 1.337 0.584 0 CA-C-N 115.591 -0.731 . . . . 0.0 112.113 179.819 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.6 m -105.03 -43.04 7.58 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 CA-C-N 116.938 0.369 . . . . 0.0 111.171 -179.632 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.0 tttt -51.84 -44.84 63.77 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.601 -179.81 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.565 HG23 ' H ' ' A' ' 18' ' ' ILE . 11.1 tt -50.29 -55.85 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 179.637 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.594 HG23 ' O ' ' A' ' 18' ' ' ILE . 9.7 tt -172.67 110.03 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 CA-C-O 121.148 0.499 . . . . 0.0 110.097 178.715 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 161.6 -44.47 0.38 Allowed Glycine 0 C--N 1.331 0.256 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.906 -179.505 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.41 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -171.89 -148.55 6.2 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 121.143 -0.551 . . . . 0.0 112.089 -179.944 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 53.48 12.28 0.35 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.844 0.354 . . . . 0.0 110.408 179.994 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -167.16 -48.93 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.349 179.907 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.9 mt -83.07 38.0 0.57 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.524 179.891 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -166.59 -15.49 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.961 -179.917 . . . . . . . . 1 1 . 1 . 065 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.35 83.91 3.11 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.738 0.304 . . . . 0.0 110.572 -179.839 . . . . . . . . 2 2 . 1 . 065 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.8 mt . . . . . 0 C--N 1.331 -0.239 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.556 179.856 . . . . . . . . 0 0 . 1 . 066 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.388 0 N-CA-C 111.963 -0.455 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 066 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -56.4 -168.21 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.77 0.319 . . . . 0.0 110.512 179.912 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 68.4 mtp180 -52.16 -80.18 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.341 179.969 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 47.5 mtpt -86.73 23.64 1.64 Allowed 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.455 179.921 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 51.6 mtm-85 54.17 -163.97 0.11 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.318 -179.749 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -72.7 79.53 1.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.874 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.63 ' H ' HD23 ' A' ' 8' ' ' LEU . 14.2 t-105 -160.68 -51.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.695 -179.846 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.63 HD23 ' H ' ' A' ' 7' ' ' TRP . 0.3 OUTLIER 19.44 -102.26 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.037 0 O-C-N 123.843 0.714 . . . . 0.0 112.607 -179.775 . . . . . . . . 3 3 . 1 . 066 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.486 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 15.5 mmt-85 -141.33 20.49 2.23 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.228 -179.81 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -46.56 -89.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.318 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 tp -73.03 -19.17 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 178.725 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.02 -45.02 88.01 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 179.143 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -47.1 -16.45 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.991 0.424 . . . . 0.0 109.909 178.681 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.61 -38.77 4.61 Favored Glycine 0 C--N 1.334 0.429 0 CA-C-N 115.642 -0.708 . . . . 0.0 112.244 179.949 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.1 m -110.96 -44.6 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 CA-C-N 116.914 0.357 . . . . 0.0 111.189 -179.597 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' N ' ' O ' ' A' ' 12' ' ' GLY . 24.8 mmtp -56.67 -34.4 67.33 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.554 -0.458 . . . . 0.0 109.925 179.931 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.1 tt -64.16 1.48 0.46 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.098 179.673 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.479 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.9 mt 62.64 96.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.295 -179.804 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -142.11 -53.26 0.04 OUTLIER Glycine 0 C--N 1.334 0.458 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 -179.882 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.501 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -176.03 -139.6 3.2 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.065 -179.968 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 56.03 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.674 0.273 . . . . 0.0 110.83 -179.96 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.501 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -71.77 -38.93 70.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.751 -179.982 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 tp -75.8 38.27 0.16 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.472 -179.876 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 22' ' ' ALA . 28.5 t70 -170.45 -37.18 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.605 -179.992 . . . . . . . . 2 2 . 1 . 066 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 54.51 105.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.545 179.914 . . . . . . . . 1 1 . 1 . 066 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 28.0 mt . . . . . 0 C--N 1.33 -0.268 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.347 179.982 . . . . . . . . 0 0 . 1 . 067 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.265 0 N-CA-C 111.986 -0.446 . . . . 0.0 111.986 . . . . . . . . . 0 0 . 1 . 067 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -58.74 -36.98 75.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.904 0.383 . . . . 0.0 110.54 179.984 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.7 mtt-85 52.18 -98.09 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.967 179.728 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 6' ' ' LYS . 49.9 mttp -94.05 37.05 1.1 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.008 -179.542 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 42.7 ttp180 53.55 -86.12 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.494 179.871 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 4' ' ' LYS . 92.9 mttt -146.94 78.63 1.5 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.967 0.413 . . . . 0.0 110.119 179.926 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.455 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 92.7 m95 -158.47 -0.6 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.214 179.98 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.475 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -76.17 -8.03 56.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.018 179.792 . . . . . . . . 3 3 . 1 . 067 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 63.97 38.61 8.59 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.042 179.89 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -46.09 -79.68 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 179.294 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mm -101.91 -13.58 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.293 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.515 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.08 -34.22 72.19 Favored Glycine 0 N--CA 1.449 -0.484 0 N-CA-C 110.766 -0.933 . . . . 0.0 110.766 179.313 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.5 ttpp -51.34 -19.07 1.16 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.24 0.543 . . . . 0.0 109.547 178.807 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.409 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.25 -46.02 2.68 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.367 -179.672 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.48 -41.49 6.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 CA-C-N 116.874 0.337 . . . . 0.0 111.434 -179.447 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.515 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.4 tttm -60.91 -33.55 73.31 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.75 -0.38 . . . . 0.0 110.581 -179.786 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.3 tt -62.18 -2.19 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.013 0.435 . . . . 0.0 110.119 179.522 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.458 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.2 mt 63.92 77.34 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.18 -179.565 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -172.52 34.32 0.13 Allowed Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.21 -179.931 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.443 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -175.71 -175.63 43.28 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.08 179.886 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.55 12.21 0.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.058 0.456 . . . . 0.0 110.148 -179.726 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.443 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -172.7 -49.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.922 179.978 . . . . . . . . 2 2 . 1 . 067 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.7 tp -83.82 59.84 5.44 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.17 179.578 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -162.92 -22.71 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.489 -179.852 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -72.19 -60.8 2.05 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.507 -179.993 . . . . . . . . 1 1 . 1 . 067 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.544 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.069 -179.965 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 N-CA-C 111.977 -0.449 . . . . 0.0 111.977 . . . . . . . . . 0 0 . 1 . 068 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.402 ' H ' ' H ' ' A' ' 3' ' ' ARG . 37.9 ptt180 -166.77 -4.43 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.691 0.282 . . . . 0.0 110.605 179.935 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.402 ' H ' ' H ' ' A' ' 2' ' ' ARG . 77.0 mtp180 -50.87 -31.29 16.93 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.888 0.375 . . . . 0.0 110.288 179.799 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.3 mtpt -146.41 159.68 43.07 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.7 179.694 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.499 ' O ' ' N ' ' A' ' 7' ' ' TRP . 15.6 ptm180 -52.7 173.83 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.372 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.441 ' CD ' ' N ' ' A' ' 6' ' ' LYS . 1.0 OUTLIER -56.42 83.84 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.832 0.349 . . . . 0.0 110.165 -179.741 . . . . . . . . 3 3 . 1 . 068 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' N ' ' O ' ' A' ' 5' ' ' ARG . 73.9 t90 -171.62 -10.71 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.745 179.965 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.485 ' CG ' ' H ' ' A' ' 9' ' ' ARG . 0.2 OUTLIER -40.56 -89.9 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.121 -179.925 . . . . . . . . 3 3 . 1 . 068 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.485 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 32.9 mmm-85 -140.55 13.49 2.34 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -179.918 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 ptm180 -40.97 -88.02 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.538 179.769 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 tp -83.04 -15.46 11.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 179.444 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.561 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.17 -48.29 84.09 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.934 -0.651 . . . . 0.0 112.49 -179.937 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.5 pttt -46.26 -16.12 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 O-C-N 122.143 -0.621 . . . . 0.0 110.404 179.391 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -95.96 -40.13 4.14 Favored Glycine 0 C--N 1.336 0.561 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.863 -179.964 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.419 HG23 ' N ' ' A' ' 16' ' ' LYS . 15.7 m -112.06 -43.65 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 120.803 0.335 . . . . 0.0 110.249 179.852 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.561 ' N ' ' O ' ' A' ' 12' ' ' GLY . 13.4 ttmm -65.51 -37.44 86.78 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.736 179.733 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 8.1 tt -42.1 -20.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.069 179.946 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.49 ' N ' ' O ' ' A' ' 16' ' ' LYS . 29.9 mt -129.42 -80.25 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.343 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 165.1 6.77 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 121.184 -0.532 . . . . 0.0 111.951 179.965 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.12 5.47 10.31 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 121.14 -0.552 . . . . 0.0 111.899 -179.959 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.58 8.46 2.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.796 0.332 . . . . 0.0 110.558 -179.99 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -162.6 -53.08 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.549 -179.94 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.0 tp -78.54 55.83 1.69 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.361 179.901 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.437 ' C ' ' H ' ' A' ' 26' ' ' LEU . 43.7 t0 -164.83 6.95 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.343 179.997 . . . . . . . . 2 2 . 1 . 068 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -52.36 -11.29 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.489 -179.999 . . . . . . . . 1 1 . 1 . 068 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.574 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.104 -179.904 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 069 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -170.3 39.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.799 0.333 . . . . 0.0 110.549 -179.997 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -73.53 -19.46 60.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.586 -179.971 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -147.83 64.47 1.12 Allowed 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 179.749 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 48.94 -158.2 0.06 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.596 -179.682 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 54.6 mttm -100.75 64.05 1.08 Allowed 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.756 -179.904 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 4.7 m-90 -160.48 11.67 0.11 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.477 179.85 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.553 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.16 -64.12 0.86 Allowed 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.965 0.412 . . . . 0.0 110.207 179.853 . . . . . . . . 3 3 . 1 . 069 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.6 tpp85 -170.56 19.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.864 179.827 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -42.54 -89.5 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.709 179.825 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.3 tp -81.46 -22.75 10.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.375 -179.743 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.28 -42.55 73.92 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.703 -0.76 . . . . 0.0 111.283 179.574 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -45.29 -21.06 0.07 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.085 0.469 . . . . 0.0 110.216 179.073 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.436 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.1 -41.08 4.4 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.641 -179.623 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.409 HG23 ' N ' ' A' ' 16' ' ' LYS . 19.7 m -111.68 -42.22 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.98 0.39 . . . . 0.0 111.495 -179.302 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 64.3 tttm -57.83 -35.51 70.99 Favored 'General case' 0 C--N 1.328 -0.369 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.588 -179.6 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.3 tt -62.5 -3.49 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 121.115 0.483 . . . . 0.0 110.174 179.754 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.422 ' H ' ' C ' ' A' ' 16' ' ' LYS . 9.0 mt 63.41 76.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.248 -179.696 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -72.18 -13.62 76.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.026 -179.913 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.66 -36.62 1.01 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.187 -0.53 . . . . 0.0 112.045 -179.924 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.423 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -51.57 -73.39 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.786 0.327 . . . . 0.0 110.497 179.93 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 -30.02 65.4 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.486 -179.991 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.3 mm? -78.69 48.07 0.78 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.004 -179.987 . . . . . . . . 2 2 . 1 . 069 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -167.04 -27.11 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.552 179.969 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.9 t60 50.61 72.62 0.33 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.607 -179.95 . . . . . . . . 1 1 . 1 . 069 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.412 HD23 ' C ' ' A' ' 26' ' ' LEU . 1.8 tt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.175 -179.888 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 111.999 -0.44 . . . . 0.0 111.999 . . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.499 ' O ' ' N ' ' A' ' 4' ' ' LYS . 41.8 mtm-85 55.84 -80.54 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.642 0.258 . . . . 0.0 110.826 179.964 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' A' ' 1' ' ' GLY . 50.7 ttp180 56.91 -80.69 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.669 179.962 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 2' ' ' ARG . 0.1 OUTLIER -111.24 53.13 0.72 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.801 0.334 . . . . 0.0 110.129 179.886 . . . . . . . . 3 3 . 1 . 070 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.485 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 10.8 mpt_? 51.61 75.05 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.146 -179.875 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.3 mttm 54.47 -165.79 0.09 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.426 -179.857 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.467 ' C ' ' H ' ' A' ' 9' ' ' ARG . 4.0 m0 60.92 10.02 2.57 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.718 179.998 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.434 ' CD2' ' N ' ' A' ' 2' ' ' ARG . 3.3 pp -73.69 20.76 0.09 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.234 -179.801 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.467 ' H ' ' C ' ' A' ' 7' ' ' TRP . 35.8 mmm-85 60.84 43.35 12.07 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.922 179.652 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.5 ptt180 -57.71 -81.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.027 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.2 tp -97.25 -16.26 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.312 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.517 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.66 -35.3 62.04 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 110.984 -0.846 . . . . 0.0 110.984 179.187 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -50.2 -16.87 0.36 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.119 0.485 . . . . 0.0 110.345 179.292 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.1 -40.14 2.51 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.406 -179.628 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.483 ' O ' ' N ' ' A' ' 19' ' ' GLY . 17.3 m -108.49 -40.92 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 CA-C-N 116.698 0.249 . . . . 0.0 111.233 -179.429 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' N ' ' O ' ' A' ' 12' ' ' GLY . 33.0 ttmt -69.16 -30.98 69.31 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.934 -0.306 . . . . 0.0 110.929 -179.838 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.6 tt -45.19 -22.3 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.052 -179.87 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.461 HG23 ' N ' ' A' ' 19' ' ' GLY . 17.1 tt -163.42 -40.57 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.793 179.801 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . 68.45 65.05 2.8 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 121.031 -0.604 . . . . 0.0 111.784 -179.793 . . . . . . . . 2 2 . 1 . 070 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -175.74 -61.62 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.258 -0.496 . . . . 0.0 111.952 -179.993 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.21 -68.07 0.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.85 0.357 . . . . 0.0 110.347 179.837 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.15 -30.98 67.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.071 179.601 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.33 61.68 3.47 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.178 179.839 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -168.12 -11.74 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.205 -179.977 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 81.2 t60 -79.85 -54.09 6.16 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.55 179.982 . . . . . . . . 1 1 . 1 . 070 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.545 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.148 -179.93 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 N-CA-C 111.964 -0.454 . . . . 0.0 111.964 . . . . . . . . . 0 0 . 1 . 071 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.454 ' CD ' ' H ' ' A' ' 2' ' ' ARG . 0.5 OUTLIER -56.38 92.49 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 -179.999 . . . . . . . . 3 3 . 1 . 071 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 55.4 ttp180 -60.74 -38.57 85.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.537 -179.871 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -162.62 53.79 0.2 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.416 -179.844 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.508 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 9.9 mpt_? 45.81 -170.11 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.576 179.873 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 63.2 mmtt -76.42 64.84 2.2 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.296 179.696 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.504 ' CZ3' ' NH2' ' A' ' 10' ' ' ARG . 98.9 m95 -157.2 9.18 0.19 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.37 -179.821 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.562 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.78 -68.87 0.14 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.894 179.935 . . . . . . . . 3 3 . 1 . 071 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -168.89 21.08 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.17 179.537 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.504 ' NH2' ' CZ3' ' A' ' 7' ' ' TRP . 8.1 ptt180 -44.3 -90.17 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.188 179.507 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.5 tp -74.25 -20.91 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 179.473 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.97 -44.39 94.54 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.597 179.872 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.15 -13.26 0.3 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.096 0.475 . . . . 0.0 109.795 179.299 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.439 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.65 -28.79 7.29 Favored Glycine 0 C--N 1.335 0.521 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.372 -179.977 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.434 HG23 ' N ' ' A' ' 16' ' ' LYS . 23.0 m -127.5 -42.59 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 CA-C-N 116.885 0.343 . . . . 0.0 111.166 -179.503 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.52 ' N ' ' O ' ' A' ' 12' ' ' GLY . 15.1 tmtt? -53.71 -53.3 54.0 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.851 0.358 . . . . 0.0 110.47 -179.912 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.9 tp -72.23 9.47 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.191 0.52 . . . . 0.0 110.188 179.968 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.43 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.5 mt 58.1 81.36 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.446 -179.965 . . . . . . . . 2 2 . 1 . 071 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -72.74 122.01 8.16 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 121.193 -0.527 . . . . 0.0 111.843 179.971 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -48.96 -50.32 27.4 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.183 -0.532 . . . . 0.0 111.991 -179.959 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -50.16 -42.24 50.64 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.772 0.32 . . . . 0.0 110.646 -179.892 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.05 -35.83 64.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.476 179.947 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 7.8 tp -79.29 51.48 1.21 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.432 -179.997 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -167.38 -54.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.583 -179.97 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 40.5 t-80 -79.63 88.96 5.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.564 179.946 . . . . . . . . 1 1 . 1 . 071 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.559 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.7 mp . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.129 179.968 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 N-CA-C 111.954 -0.459 . . . . 0.0 111.954 . . . . . . . . . 0 0 . 1 . 072 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' O ' ' N ' ' A' ' 4' ' ' LYS . 73.1 mtt85 -58.63 -69.43 0.19 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.74 0.305 . . . . 0.0 110.562 -179.908 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 70.2 mtp180 49.73 -91.67 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.344 -179.908 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.455 ' N ' ' O ' ' A' ' 2' ' ' ARG . 68.1 mmtt -103.07 138.19 40.25 Favored 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.632 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -71.02 74.82 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.858 0.361 . . . . 0.0 110.702 -179.834 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.494 ' O ' ' NE ' ' A' ' 10' ' ' ARG . 91.1 mttt 56.27 35.56 25.99 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.042 179.624 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 69.3 m95 -124.53 8.0 8.31 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 108.747 -0.835 . . . . 0.0 108.747 178.91 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.35 42.94 0.29 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.236 179.512 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.612 ' N ' ' HE ' ' A' ' 9' ' ' ARG . 4.8 mmp_? 60.68 37.99 18.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.874 179.55 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.494 ' NE ' ' O ' ' A' ' 6' ' ' LYS . 7.2 ptt85 -49.18 -82.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.18 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.5 tt -95.31 -14.02 8.08 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.364 179.319 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.48 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.69 -40.49 88.59 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.412 -0.899 . . . . 0.0 111.34 179.801 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt -49.93 -16.47 0.28 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.204 0.526 . . . . 0.0 109.616 178.85 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.86 -45.03 3.22 Favored Glycine 0 C--N 1.335 0.473 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.282 179.93 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.404 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.5 m -109.38 -42.68 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 116.959 0.38 . . . . 0.0 111.47 -179.497 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.48 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.5 tttt -49.28 -48.7 45.82 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.622 -179.573 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.8 tt -59.11 -32.17 47.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.037 179.707 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.583 HG23 ' O ' ' A' ' 18' ' ' ILE . 9.3 tt -171.38 113.15 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 CA-C-O 121.172 0.511 . . . . 0.0 110.653 179.077 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.423 ' O ' ' N ' ' A' ' 21' ' ' ALA . . . -80.05 56.5 4.59 Favored Glycine 0 C--N 1.33 0.249 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 -179.997 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.428 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -44.21 -19.68 0.14 Allowed Glycine 0 C--N 1.331 0.293 0 C-N-CA 121.361 -0.447 . . . . 0.0 112.415 -179.768 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.423 ' N ' ' O ' ' A' ' 19' ' ' GLY . . . -77.08 18.97 0.33 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.862 0.363 . . . . 0.0 110.608 179.983 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -163.29 -39.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.322 179.937 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.516 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.3 mm? -78.89 56.52 1.95 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.808 179.846 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -163.29 -39.39 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.494 -179.761 . . . . . . . . 1 1 . 1 . 072 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -74.83 71.17 1.98 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.674 -179.969 . . . . . . . . 2 2 . 1 . 072 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.441 HD12 ' C ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.331 -0.219 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.495 179.956 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.337 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 . . . . . . . . . 0 0 . 1 . 073 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.2 ptt180 -161.77 54.01 0.25 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.805 0.336 . . . . 0.0 110.608 179.974 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 15.7 mmt85 -61.43 -26.99 68.23 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.374 179.765 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -164.27 63.86 0.15 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.638 179.99 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 25.3 ttt85 59.88 -125.7 1.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.102 179.899 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.566 ' NZ ' ' NH2' ' A' ' 10' ' ' ARG . 62.2 mttm -122.3 86.29 2.56 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.82 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.487 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 93.1 m95 -158.74 -3.89 0.08 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.563 -179.765 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.574 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -67.63 -89.26 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.562 -0.532 . . . . 0.0 109.562 179.801 . . . . . . . . 3 3 . 1 . 073 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -173.89 18.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.641 -0.424 . . . . 0.0 111.324 -179.98 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.566 ' NH2' ' NZ ' ' A' ' 6' ' ' LYS . 2.0 ptp180 -46.92 -88.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 179.735 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 20.0 tt -85.57 -12.63 11.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.792 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.512 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.66 -41.51 74.55 Favored Glycine 0 N--CA 1.45 -0.392 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.65 179.775 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -47.76 -16.7 0.08 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.018 0.437 . . . . 0.0 110.139 179.121 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.461 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.07 -44.26 2.26 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.399 179.943 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.2 m -103.57 -41.53 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 CA-C-N 116.976 0.388 . . . . 0.0 110.9 -179.647 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.512 ' N ' ' O ' ' A' ' 12' ' ' GLY . 83.1 tttt -59.32 -35.46 73.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.689 0.28 . . . . 0.0 110.528 179.912 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.6 tt -68.49 4.56 0.49 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.069 0.462 . . . . 0.0 110.017 179.799 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.452 ' H ' ' C ' ' A' ' 16' ' ' LYS . 18.3 mt 61.89 61.86 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.383 -179.914 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -78.48 74.36 2.1 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.979 179.96 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.425 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 72.57 89.73 0.13 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 121.047 -0.597 . . . . 0.0 112.101 179.806 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.67 12.34 0.17 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.819 -0.352 . . . . 0.0 110.495 179.786 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.425 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . 57.57 43.45 22.57 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 -178.71 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 59.46 20.44 8.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 107.821 -1.177 . . . . 0.0 107.821 -178.342 . . . . . . . . 2 2 . 1 . 073 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 40.1 t0 45.99 40.95 7.56 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 115.126 -0.943 . . . . 0.0 109.915 -179.237 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -68.22 -66.73 0.53 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.633 -179.963 . . . . . . . . 1 1 . 1 . 073 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.793 -179.806 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.283 0 N-CA-C 111.935 -0.466 . . . . 0.0 111.935 . . . . . . . . . 0 0 . 1 . 074 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.504 ' CD ' ' N ' ' A' ' 2' ' ' ARG . 9.3 mpt_? -78.94 58.79 2.47 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.762 0.315 . . . . 0.0 110.331 -179.999 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -68.93 -52.85 24.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.54 179.966 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' A' ' 6' ' ' LYS . 12.5 mptt -79.95 19.55 0.69 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.316 -179.862 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 65.8 mtt-85 53.21 -86.28 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 4' ' ' LYS . 51.3 mttm -142.84 53.44 1.39 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.167 179.984 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 91.3 m95 -151.08 8.62 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.652 179.824 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.668 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.8 pt? -48.49 -36.63 15.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.233 -179.723 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.554 HH22 ' CA ' ' A' ' 17' ' ' ILE . 6.7 mmt180 159.22 24.66 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.83 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.0 ptp180 -42.26 -91.33 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.849 179.772 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.6 tp -92.27 -19.37 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.138 -179.9 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.11 -38.03 60.11 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.03 -0.605 . . . . 0.0 111.738 179.647 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -50.15 -16.59 0.32 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.041 0.448 . . . . 0.0 110.251 179.63 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.428 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.39 -39.69 2.96 Favored Glycine 0 C--N 1.333 0.399 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.422 -179.808 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.493 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.3 m -109.19 -43.19 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 116.78 0.29 . . . . 0.0 111.189 -179.5 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 87.1 tttt -58.41 -39.61 80.18 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.734 -0.387 . . . . 0.0 110.499 -179.854 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.554 ' CA ' HH22 ' A' ' 9' ' ' ARG . 15.4 tt -49.97 -28.02 4.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.504 179.911 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.689 HG23 ' O ' ' A' ' 18' ' ' ILE . 16.9 tt -170.15 63.2 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-O 121.4 0.619 . . . . 0.0 110.346 179.868 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.493 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -174.79 -31.31 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.04 -0.6 . . . . 0.0 111.967 -179.968 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.439 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -72.75 70.97 1.13 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 121.129 -0.557 . . . . 0.0 111.958 179.963 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 54.03 9.98 0.25 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.182 -179.926 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.439 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . 57.88 45.69 17.98 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 -178.691 . . . . . . . . 2 2 . 1 . 074 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 18.1 mt 57.89 17.11 4.05 Favored 'General case' 0 N--CA 1.45 -0.426 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 -178.214 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.4 t70 49.5 48.45 21.31 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.685 -179.099 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 16.3 t60 -76.42 -59.14 2.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.807 -179.663 . . . . . . . . 1 1 . 1 . 074 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.542 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.1 mp . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.081 -179.931 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.445 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 111.909 -0.476 . . . . 0.0 111.909 . . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 23.6 mmt180 -76.24 19.81 0.23 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.684 0.278 . . . . 0.0 110.516 179.998 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' A' ' 1' ' ' GLY . 78.1 ttt180 -56.29 -44.97 80.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.5 -179.977 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.5 ptmt -157.57 69.1 0.54 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.052 0.453 . . . . 0.0 110.666 -179.851 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.481 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 8.9 mpt_? 54.03 -103.98 0.19 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.297 179.864 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.495 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 85.2 mttt -146.31 81.41 1.58 Allowed 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.316 -179.871 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.495 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 96.5 m95 -159.35 7.29 0.1 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.334 179.919 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.541 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -47.95 -68.96 0.14 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.126 -179.925 . . . . . . . . 3 3 . 1 . 075 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.8 tpp85 -165.65 18.54 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.256 179.918 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -45.36 -88.89 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.046 179.413 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.3 tt -80.48 -17.96 12.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.363 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -53.13 -45.79 62.87 Favored Glycine 0 N--CA 1.451 -0.309 0 N-CA-C 111.609 -0.597 . . . . 0.0 111.609 179.568 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -47.62 -15.66 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.159 0.504 . . . . 0.0 110.047 179.044 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -100.17 -40.61 3.0 Favored Glycine 0 C--N 1.334 0.464 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.474 -179.979 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.0 m -107.7 -41.34 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 CA-C-N 117.129 0.464 . . . . 0.0 111.051 -179.517 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' A' ' 12' ' ' GLY . 20.6 tptp -51.24 -59.35 4.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.767 0.318 . . . . 0.0 110.321 179.85 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.4 tt -65.29 0.77 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.47 . . . . 0.0 110.094 179.769 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.451 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.2 mt 63.87 107.49 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.415 -179.947 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.49 -87.75 0.07 OUTLIER Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.67 179.992 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.21 -33.33 45.43 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 121.076 -0.583 . . . . 0.0 111.778 179.844 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.55 -51.95 51.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.837 0.351 . . . . 0.0 110.429 179.867 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.46 -43.13 64.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.325 179.8 . . . . . . . . 1 1 . 1 . 075 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.528 HD12 ' N ' ' A' ' 23' ' ' LEU . 7.5 mp -81.73 63.16 5.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.084 179.894 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.423 ' H ' ' H ' ' A' ' 25' ' ' HIS . 33.2 t70 -170.32 -16.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.29 179.897 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.423 ' H ' ' H ' ' A' ' 24' ' ' ASP . 19.0 t60 -92.3 98.59 11.59 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.586 179.951 . . . . . . . . 2 2 . 1 . 075 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' N ' ' CD2' ' A' ' 26' ' ' LEU . 2.4 mm? . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.048 179.936 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.317 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 076 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 4' ' ' LYS . 89.0 mtt180 -63.36 -68.41 0.34 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.836 0.35 . . . . 0.0 110.508 -179.99 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 58.12 -78.23 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.956 179.897 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 2' ' ' ARG . 74.0 mttt -85.62 24.41 1.22 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.74 0.305 . . . . 0.0 110.613 -179.797 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.4 mtm180 50.47 -121.15 1.67 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.194 -179.775 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -99.64 68.06 1.53 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 179.6 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 69.9 t-105 -163.03 4.28 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.779 -179.709 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.534 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -46.52 -70.85 0.09 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.399 -179.93 . . . . . . . . 3 3 . 1 . 076 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.57 18.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.15 -179.9 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.6 ptp180 -41.92 -89.7 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.329 179.815 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.6 pt -80.25 -17.26 12.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 179.241 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.485 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.84 -41.64 94.2 Favored Glycine 0 CA--C 1.507 -0.44 0 N-CA-C 110.815 -0.914 . . . . 0.0 110.815 179.61 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -48.8 -15.88 0.11 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.254 0.549 . . . . 0.0 109.683 178.46 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.468 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -100.25 -45.45 2.01 Favored Glycine 0 C--N 1.337 0.607 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.607 -179.895 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.9 p -102.18 -40.38 7.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 117.205 0.503 . . . . 0.0 110.971 -179.389 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.485 ' N ' ' O ' ' A' ' 12' ' ' GLY . 55.6 tttm -53.51 -62.68 1.5 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.823 0.344 . . . . 0.0 110.443 -179.983 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.6 tt -75.39 10.51 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.327 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.122 -179.93 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.7 mt 60.04 99.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.23 -179.851 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -74.08 115.59 4.97 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 121.291 -0.48 . . . . 0.0 112.177 -179.725 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.44 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -76.9 -8.56 86.7 Favored Glycine 0 N--CA 1.453 -0.217 0 N-CA-C 111.825 -0.51 . . . . 0.0 111.825 179.793 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.44 13.79 0.55 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.853 0.359 . . . . 0.0 110.489 179.878 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.44 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.48 -54.71 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.243 179.967 . . . . . . . . 2 2 . 1 . 076 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 13.6 mt -79.62 57.95 2.6 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.47 179.869 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -166.75 -2.68 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.703 -179.879 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 76.7 t60 -71.39 -42.89 67.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.529 179.995 . . . . . . . . 1 1 . 1 . 076 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.0 mt . . . . . 0 C--N 1.331 -0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.661 -179.965 . . . . . . . . 0 0 . 1 . 077 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.279 0 N-CA-C 112.011 -0.436 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 077 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -76.68 63.45 2.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.758 0.313 . . . . 0.0 110.656 179.987 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 65.5 mtp85 -80.37 -48.82 12.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.592 -179.977 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.418 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 39.4 mtpt -99.15 18.71 16.79 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.8 -179.916 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 20.9 mmm180 54.15 84.13 0.07 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.844 179.711 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.488 ' CD ' ' N ' ' A' ' 6' ' ' LYS . 2.9 mptp? 46.2 67.35 0.77 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.776 179.651 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 63.8 t-105 -171.32 7.15 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.37 179.864 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.821 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.2 -70.82 0.08 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.635 -179.701 . . . . . . . . 3 3 . 1 . 077 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -172.35 16.36 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.927 -179.996 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.9 ptt85 -40.03 -89.59 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.382 179.914 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.8 tt -83.31 -16.6 11.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.238 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.495 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.96 -41.74 85.22 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.296 -0.722 . . . . 0.0 111.296 179.501 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -48.83 -15.2 0.08 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.037 0.446 . . . . 0.0 110.165 179.023 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.446 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.86 -40.69 2.1 Favored Glycine 0 C--N 1.337 0.632 0 CA-C-N 115.995 -0.548 . . . . 0.0 112.724 -179.702 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.5 m -106.78 -37.92 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.712 0 CA-C-N 117.055 0.428 . . . . 0.0 111.091 -179.469 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 12' ' ' GLY . 84.5 tttt -62.56 -45.95 90.58 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.909 -179.772 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.6 tp -51.78 -31.37 13.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 110.297 -179.713 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.438 ' CG1' ' H ' ' A' ' 19' ' ' GLY . 3.2 pt -117.03 -108.77 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.086 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.438 ' H ' ' CG1' ' A' ' 18' ' ' ILE . . . -166.16 11.97 0.07 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 121.271 -0.49 . . . . 0.0 111.901 179.916 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 72.49 -13.57 2.84 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.017 -179.924 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -74.7 -54.38 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.79 0.329 . . . . 0.0 110.518 -179.925 . . . . . . . . 2 2 . 1 . 077 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.98 -12.18 3.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.631 -179.988 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.3 tp -67.46 -27.49 67.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 -179.93 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -155.02 57.22 0.66 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.512 -179.964 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 59.5 t60 -54.84 137.56 44.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.543 -179.992 . . . . . . . . 1 1 . 1 . 077 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.545 ' N ' HD12 ' A' ' 26' ' ' LEU . 9.6 mp . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.051 179.981 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.406 ' O ' ' O ' ' A' ' 2' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.012 -0.435 . . . . 0.0 112.012 . . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.406 ' O ' ' O ' ' A' ' 1' ' ' GLY . 51.3 mtm180 59.79 146.94 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.858 0.361 . . . . 0.0 110.728 -179.981 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 57.9 ttt-85 -167.37 -53.26 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.592 179.955 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.527 ' C ' ' H ' ' A' ' 6' ' ' LYS . 19.3 ptmt -166.04 33.1 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.543 179.993 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.422 ' CD ' ' N ' ' A' ' 5' ' ' ARG . 11.4 mpt_? 59.1 -6.12 0.06 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.788 179.901 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.527 ' H ' ' C ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -144.43 164.01 32.1 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.9 0.381 . . . . 0.0 110.192 179.792 . . . . . . . . 3 3 . 1 . 078 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.4 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 72.5 t-105 56.36 6.67 0.28 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.069 179.62 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.548 ' CD1' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -69.49 -84.45 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.653 . . . . . . . . 3 3 . 1 . 078 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.548 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 18.6 mmt85 -136.0 16.5 3.27 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 179.965 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -44.34 -88.5 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 179.705 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 5.7 tp -81.9 -15.66 12.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.889 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.487 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.9 -38.55 85.08 Favored Glycine 0 C--N 1.335 0.478 0 N-CA-C 111.288 -0.725 . . . . 0.0 111.288 179.387 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -51.75 -12.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.074 0.464 . . . . 0.0 110.073 179.212 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' H ' ' C ' ' A' ' 12' ' ' GLY . . . -104.91 -39.38 2.33 Favored Glycine 0 C--N 1.336 0.538 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.565 -179.778 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.3 p -108.07 -41.07 5.13 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 CA-C-N 116.935 0.367 . . . . 0.0 110.892 -179.409 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' N ' ' O ' ' A' ' 12' ' ' GLY . 18.8 tptm -56.22 -54.1 49.26 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.164 -179.99 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 tt -76.02 14.64 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 109.836 179.767 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.436 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 60.58 111.14 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.426 -179.946 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -167.28 -105.68 0.19 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.189 -0.529 . . . . 0.0 111.819 -179.946 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.446 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -68.33 -153.02 0.45 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 121.064 -0.589 . . . . 0.0 111.785 179.931 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.08 15.09 0.16 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.946 0.403 . . . . 0.0 110.217 -179.703 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.446 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -164.38 -57.57 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.854 179.992 . . . . . . . . 2 2 . 1 . 078 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 40.9 mt -80.77 23.47 0.53 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.115 179.533 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -168.02 14.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.669 -179.832 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -61.87 -59.35 5.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.533 -179.944 . . . . . . . . 1 1 . 1 . 078 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.548 ' N ' HD23 ' A' ' 26' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.914 -179.843 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.009 -0.436 . . . . 0.0 112.009 . . . . . . . . . 0 0 . 1 . 079 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.7 ttt85 -170.1 -53.83 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.845 0.355 . . . . 0.0 110.45 -179.939 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -75.92 -29.53 58.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.546 -179.981 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -155.28 61.33 0.63 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.487 -179.751 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 43.89 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.082 179.912 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -84.16 69.23 10.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.198 179.895 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.51 ' CE2' ' NH2' ' A' ' 9' ' ' ARG . 71.5 t-105 -146.19 -9.39 0.51 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.13 -179.803 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -70.94 14.97 0.12 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.431 -179.855 . . . . . . . . 3 3 . 1 . 079 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.51 ' NH2' ' CE2' ' A' ' 7' ' ' TRP . 44.1 mmt-85 64.62 43.03 4.49 Favored 'General case' 0 CA--C 1.521 -0.155 0 O-C-N 123.065 0.228 . . . . 0.0 111.271 179.508 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -53.77 -93.01 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.643 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.4 tp -78.36 -16.5 13.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 178.687 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -59.21 -40.0 95.24 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 120.525 -0.845 . . . . 0.0 110.99 179.274 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.7 tmmm? -52.36 -14.35 0.46 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.269 0.557 . . . . 0.0 109.866 179.119 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -101.89 -29.6 6.1 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.55 -179.686 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.407 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.3 m -124.61 -42.29 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.765 0.283 . . . . 0.0 111.168 -179.355 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 57.5 tttp -59.8 -50.79 72.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.669 -0.241 . . . . 0.0 110.844 -179.615 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 2.8 tp -75.28 16.73 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 121.178 0.513 . . . . 0.0 110.335 -179.886 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.438 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.7 mm 58.04 87.21 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.357 179.923 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.53 70.36 1.94 Allowed Glycine 0 N--CA 1.45 -0.378 0 N-CA-C 111.817 -0.513 . . . . 0.0 111.817 179.918 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -42.7 -35.46 2.11 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.252 -179.863 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.29 -49.8 60.56 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.758 0.314 . . . . 0.0 110.612 -180.0 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.461 ' C ' ' H ' ' A' ' 24' ' ' ASP . . . -79.91 -43.17 22.67 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.954 -179.656 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.8 mt -74.73 25.53 0.09 Allowed 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.136 -179.626 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.461 ' H ' ' C ' ' A' ' 22' ' ' ALA . 46.9 t0 -171.32 -6.33 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.808 0.337 . . . . 0.0 110.295 179.561 . . . . . . . . 2 2 . 1 . 079 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 15.2 m80 54.71 75.68 0.29 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.489 -179.908 . . . . . . . . 1 1 . 1 . 079 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 10.3 tp . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.314 -179.974 . . . . . . . . 0 0 . 1 . 080 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 111.93 -0.468 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 080 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 15.9 ptt180 -71.94 72.58 0.84 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.952 0.406 . . . . 0.0 110.22 179.869 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.3 ttm-85 -67.45 -41.35 84.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.703 -179.821 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.4 ptmm? -161.02 49.82 0.24 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.475 -179.783 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 50.8 mtt85 55.71 -163.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.324 179.997 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.482 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 84.5 mttt -74.21 79.44 1.79 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.056 -179.402 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.482 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 91.6 m95 -160.34 1.67 0.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.152 179.656 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -51.21 -86.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.014 -0.365 . . . . 0.0 110.014 179.652 . . . . . . . . 3 3 . 1 . 080 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.417 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 5.7 tpp85 -160.82 23.92 0.14 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.266 179.931 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 ptt85 -49.08 -89.32 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.842 179.442 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.2 mm -78.29 -19.9 13.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 179.32 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.92 -38.53 89.21 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 179.397 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -51.28 -17.18 0.65 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 178.658 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.04 -47.01 2.13 Favored Glycine 0 C--N 1.334 0.448 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.119 179.942 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.5 m -101.67 -42.81 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-N 116.918 0.359 . . . . 0.0 111.137 -179.701 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.518 ' N ' ' O ' ' A' ' 12' ' ' GLY . 19.7 tptm -61.83 -30.08 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.17 179.945 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.2 tt -62.5 -0.87 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.913 0.387 . . . . 0.0 110.047 179.52 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.486 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.8 mt 64.54 75.18 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.305 -179.874 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -165.98 32.82 0.23 Allowed Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.642 -179.985 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -162.51 -41.16 0.02 OUTLIER Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.752 -0.539 . . . . 0.0 111.752 179.991 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.96 -66.38 0.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.835 0.35 . . . . 0.0 110.282 179.742 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -79.72 -34.68 39.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.331 179.76 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.91 76.18 5.4 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 121.307 0.575 . . . . 0.0 109.738 179.98 . . . . . . . . 2 2 . 1 . 080 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -172.28 -31.02 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.009 -179.829 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -79.45 63.63 4.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.644 179.946 . . . . . . . . 1 1 . 1 . 080 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.3 mt . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.458 179.96 . . . . . . . . 0 0 . 1 . 081 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.409 ' C ' ' N ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.05 -0.42 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 081 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.494 ' C ' ' H ' ' A' ' 4' ' ' LYS . 47.1 ttp180 -50.49 -14.21 0.17 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.838 0.352 . . . . 0.0 110.517 179.974 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.409 ' N ' ' C ' ' A' ' 1' ' ' GLY . 89.9 mtm180 -75.85 30.41 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.359 179.501 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.5 ' O ' ' N ' ' A' ' 6' ' ' LYS . 3.7 tmtm? -169.39 -50.48 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 -179.847 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -56.03 83.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.383 179.237 . . . . . . . . 1 1 . 1 . 081 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.5 ' N ' ' O ' ' A' ' 4' ' ' LYS . 64.2 mmtt 59.39 69.24 0.73 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.589 -179.919 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.441 ' C ' ' H ' ' A' ' 9' ' ' ARG . 78.9 t90 -160.26 -16.76 0.05 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.649 179.532 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.748 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.0 pt? -70.46 9.95 0.54 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.876 179.85 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.441 ' H ' ' C ' ' A' ' 7' ' ' TRP . 10.3 mmm180 54.08 53.13 11.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.911 0.386 . . . . 0.0 110.301 179.97 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.545 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 13.4 ptt85 -68.57 -60.15 2.63 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.64 -179.871 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.545 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 17.3 tt -112.07 -19.09 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.707 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.571 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.11 -46.23 70.78 Favored Glycine 0 N--CA 1.447 -0.596 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.841 179.649 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 13.0 pttp -50.27 -13.62 0.13 Allowed 'General case' 0 C--N 1.328 -0.358 0 O-C-N 121.94 -0.741 . . . . 0.0 109.924 179.236 . . . . . . . . 1 1 . 1 . 081 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.477 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -95.76 -44.28 3.17 Favored Glycine 0 C--N 1.335 0.48 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.488 179.847 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.486 ' O ' ' N ' ' A' ' 19' ' ' GLY . 15.7 m -108.35 -43.37 6.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.831 0.348 . . . . 0.0 110.347 179.706 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.571 ' N ' ' O ' ' A' ' 12' ' ' GLY . 33.4 ttmt -64.88 -41.26 95.78 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.294 179.931 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 4.5 tp -38.69 -36.98 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.62 -179.617 . . . . . . . . 1 1 . 1 . 081 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.568 HG23 ' O ' ' A' ' 18' ' ' ILE . 12.0 tt -163.46 39.77 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 121.422 0.63 . . . . 0.0 110.687 -179.587 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 15' ' ' VAL . . . -150.6 7.28 0.69 Allowed Glycine 0 C--N 1.331 0.281 0 N-CA-C 111.407 -0.677 . . . . 0.0 111.407 179.479 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.408 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -152.2 -27.0 0.04 OUTLIER Glycine 0 C--N 1.332 0.334 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 179.783 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.22 16.23 0.81 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.93 0.395 . . . . 0.0 110.181 179.643 . . . . . . . . 1 1 . 1 . 081 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.408 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -158.92 -38.57 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.195 -179.984 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.527 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.1 mp -78.87 56.35 1.91 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.181 -0.463 . . . . 0.0 109.849 179.736 . . . . . . . . 2 2 . 1 . 081 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -166.23 -48.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.527 -179.937 . . . . . . . . 1 1 . 1 . 081 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 53.9 61.37 3.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.559 -179.942 . . . . . . . . 1 1 . 1 . 081 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' CD2' ' N ' ' A' ' 26' ' ' LEU . 2.3 mm? . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.139 179.986 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.221 0 N-CA-C 111.953 -0.459 . . . . 0.0 111.953 . . . . . . . . . 0 0 . 1 . 082 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.6 ptm180 -171.01 27.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.84 0.352 . . . . 0.0 110.442 -179.973 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 47.1 ttp180 -62.24 -14.43 38.23 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.594 -179.889 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -159.79 77.52 0.67 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.73 -179.966 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.1 mtt85 47.74 -106.87 0.17 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 179.633 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -149.18 81.59 1.42 Allowed 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.829 0.347 . . . . 0.0 110.246 -179.876 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.467 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 73.8 t-105 -171.17 7.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.164 -179.934 . . . . . . . . 2 2 . 1 . 082 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.569 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -50.65 -69.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.106 -179.883 . . . . . . . . 3 3 . 1 . 082 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 15.1 tpp180 -160.36 20.46 0.15 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.006 -179.959 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -44.81 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.915 179.493 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 9.1 pt -80.51 -19.17 11.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.143 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.49 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.43 -39.37 73.15 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.564 -1.014 . . . . 0.0 110.564 179.328 . . . . . . . . 2 2 . 1 . 082 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.4 ttpp -46.52 -19.35 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.192 0.52 . . . . 0.0 109.909 178.642 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.04 -46.27 2.67 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.215 -179.919 . . . . . . . . 2 2 . 1 . 082 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 14.4 m -100.47 -44.57 11.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.777 0 CA-C-N 117.033 0.417 . . . . 0.0 111.466 -179.501 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.49 ' N ' ' O ' ' A' ' 12' ' ' GLY . 23.6 mmtp -59.7 -32.66 70.72 Favored 'General case' 0 C--N 1.332 -0.175 0 C-N-CA 120.274 -0.57 . . . . 0.0 110.111 -179.868 . . . . . . . . 2 2 . 1 . 082 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.7 tt -63.14 -1.83 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-O 121.077 0.465 . . . . 0.0 109.863 179.496 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.456 ' H ' ' C ' ' A' ' 16' ' ' LYS . 10.6 mt 64.01 85.91 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.291 -179.613 . . . . . . . . 2 2 . 1 . 082 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -134.02 -124.01 2.44 Favored Glycine 0 C--N 1.335 0.523 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 179.988 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.41 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . -56.34 -162.84 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 121.077 -0.583 . . . . 0.0 111.931 -179.964 . . . . . . . . 2 2 . 1 . 082 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.33 14.14 0.35 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.953 0.406 . . . . 0.0 110.339 -179.89 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -168.49 -51.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.079 179.983 . . . . . . . . 2 2 . 1 . 082 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.4 tp -80.69 63.01 4.95 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.222 179.787 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -160.91 -25.68 0.06 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.518 -179.822 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 45.9 m170 -77.59 -53.99 6.93 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.666 179.929 . . . . . . . . 1 1 . 1 . 082 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.525 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.6 mp . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.118 -179.915 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.356 0 N-CA-C 111.969 -0.453 . . . . 0.0 111.969 . . . . . . . . . 0 0 . 1 . 083 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -167.01 105.95 0.58 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.829 0.347 . . . . 0.0 110.535 -179.98 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 62.7 mtt85 -135.2 -17.34 1.83 Allowed 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.158 179.978 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.8 ptpt -163.88 59.2 0.16 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.086 179.769 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.513 ' O ' ' N ' ' A' ' 7' ' ' TRP . 46.6 ttt85 59.64 151.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.249 -179.711 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -53.44 84.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.55 -179.934 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.513 ' N ' ' O ' ' A' ' 5' ' ' ARG . 75.7 t-105 -171.87 10.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.408 -179.812 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.551 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -48.29 -68.42 0.18 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.169 -179.903 . . . . . . . . 3 3 . 1 . 083 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -166.15 18.76 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.157 179.937 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -43.84 -89.08 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.344 179.748 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.4 tp -80.5 -19.75 11.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.635 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.81 -41.92 84.56 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.538 -0.625 . . . . 0.0 111.538 179.606 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.5 tmmm? -49.89 -18.11 0.47 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.493 0.664 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -93.32 -40.83 4.69 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.345 -0.843 . . . . 0.0 112.853 -179.805 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.6 p -113.12 -40.78 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 CA-C-N 117.272 0.536 . . . . 0.0 111.247 -179.184 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.4 tptt -51.14 -57.26 9.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.374 179.967 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.4 tt -71.5 -2.14 2.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-O 121.211 0.529 . . . . 0.0 109.624 179.442 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.9 mt 61.86 80.25 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.462 179.853 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.95 80.86 1.56 Allowed Glycine 0 C--N 1.332 0.33 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.02 179.959 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -53.79 -11.29 1.97 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.814 179.915 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.55 16.41 0.37 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.73 0.3 . . . . 0.0 110.55 179.894 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -161.47 -42.31 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.4 -179.955 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.534 HD12 ' N ' ' A' ' 23' ' ' LEU . 8.2 mp -79.87 58.97 3.01 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.026 179.914 . . . . . . . . 2 2 . 1 . 083 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -162.08 -55.19 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.961 179.992 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -95.94 77.49 3.17 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.542 179.854 . . . . . . . . 1 1 . 1 . 083 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.56 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.3 mp . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.179 179.956 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 3' ' ' ARG . . . . . . . . 0 N--CA 1.451 -0.361 0 N-CA-C 111.926 -0.47 . . . . 0.0 111.926 . . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 34.9 ttt85 65.79 -3.07 0.78 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.885 0.374 . . . . 0.0 110.391 179.984 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.434 ' H ' ' C ' ' A' ' 1' ' ' GLY . 38.3 ttm180 -69.2 -19.34 63.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.381 179.811 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.2 mttm -135.47 37.74 2.91 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.441 -179.925 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.0 mmt180 54.27 -163.24 0.12 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.681 179.77 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.437 ' CD ' ' N ' ' A' ' 6' ' ' LYS . 0.9 OUTLIER -64.14 98.34 0.22 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.186 179.974 . . . . . . . . 3 3 . 1 . 084 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.541 ' H ' HD23 ' A' ' 8' ' ' LEU . 77.0 t-105 -166.29 -83.16 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.248 179.727 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.541 HD23 ' H ' ' A' ' 7' ' ' TRP . 0.3 OUTLIER 24.43 -103.63 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.21 0.604 . . . . 0.0 112.465 179.394 . . . . . . . . 3 3 . 1 . 084 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.461 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 6.3 tpp85 -168.96 31.32 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.006 -179.769 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -53.16 -89.61 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.359 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.0 tt -84.09 -14.79 11.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.807 -0.442 . . . . 0.0 109.807 179.187 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -52.51 -46.46 58.49 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.493 179.656 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -43.88 -18.99 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.999 0.428 . . . . 0.0 110.337 178.903 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -96.79 -43.36 3.12 Favored Glycine 0 C--N 1.335 0.493 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.391 -179.982 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.7 m -105.41 -42.8 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 117.034 0.417 . . . . 0.0 110.889 -179.653 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 12' ' ' GLY . 7.1 tmtm? -56.56 -35.98 68.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.722 0.296 . . . . 0.0 110.274 179.99 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.8 tt -65.39 1.92 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 CA-C-O 121.006 0.431 . . . . 0.0 110.232 -179.975 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.453 ' H ' ' C ' ' A' ' 16' ' ' LYS . 12.2 mt 63.14 89.27 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.446 180.0 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -169.97 11.53 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.377 -0.689 . . . . 0.0 111.377 179.883 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 22' ' ' ALA . . . -169.99 -143.79 4.05 Favored Glycine 0 N--CA 1.45 -0.417 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 -179.995 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 52.3 -87.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.749 0.309 . . . . 0.0 110.369 179.932 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.502 ' N ' ' O ' ' A' ' 20' ' ' GLY . . . -77.25 -47.42 20.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.235 179.765 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 14.6 mt -79.81 70.08 6.26 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.473 179.872 . . . . . . . . 1 1 . 1 . 084 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.453 ' OD2' ' N ' ' A' ' 25' ' ' HIS . 58.4 p-10 -167.47 -14.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.387 -179.968 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.453 ' N ' ' OD2' ' A' ' 24' ' ' ASP . 12.8 t-80 -74.06 101.79 4.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 -179.943 . . . . . . . . 2 2 . 1 . 084 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.495 179.861 . . . . . . . . 0 0 . 1 . 085 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 . . . . . . . . . 0 0 . 1 . 085 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 25.5 ptt180 -169.61 59.2 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.868 0.366 . . . . 0.0 110.319 179.998 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 57.8 mtp180 -50.26 -39.61 45.56 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.811 -179.853 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 61.3 tttp -156.44 64.67 0.54 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.457 -179.796 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 78.0 mtt-85 42.61 -91.47 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.98 179.909 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.496 ' N ' ' O ' ' A' ' 4' ' ' LYS . 66.8 mmtt -123.18 -178.32 3.94 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.935 179.698 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 15.9 t90 58.38 3.47 0.27 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.939 179.861 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' CD1' ' H ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -56.54 -83.68 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 179.697 . . . . . . . . 3 3 . 1 . 085 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.509 ' H ' ' CD1' ' A' ' 8' ' ' LEU . 15.1 mmm180 -140.08 19.6 2.45 Favored 'General case' 0 N--CA 1.465 0.316 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.994 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -47.23 -88.74 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.371 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 tt -82.46 -14.64 12.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 178.879 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.489 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.44 -39.86 84.82 Favored Glycine 0 C--N 1.334 0.428 0 N-CA-C 111.219 -0.752 . . . . 0.0 111.219 179.494 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 33.0 ttpt -50.88 -13.75 0.17 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.173 0.511 . . . . 0.0 109.934 178.913 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.432 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.99 -42.06 2.16 Favored Glycine 0 C--N 1.335 0.506 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.54 -179.866 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.432 ' O ' ' N ' ' A' ' 19' ' ' GLY . 16.5 m -105.6 -40.23 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 116.927 0.363 . . . . 0.0 111.169 -179.454 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.489 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.0 tttp -69.67 -28.3 65.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.731 0.3 . . . . 0.0 111.049 -179.723 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.8 tt -50.11 -20.85 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.969 -179.578 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.533 HG23 ' N ' ' A' ' 19' ' ' GLY . 6.5 tp -155.01 -46.47 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 121.077 -0.249 . . . . 0.0 110.563 179.829 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.533 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 164.75 -28.54 0.21 Allowed Glycine 0 C--N 1.331 0.26 0 C-N-CA 121.064 -0.589 . . . . 0.0 112.103 -179.972 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 80.32 -51.5 4.18 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.055 -179.92 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.04 -47.68 61.68 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.751 0.31 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.1 -36.8 61.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.51 -179.972 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 tp -80.52 53.59 1.88 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.493 -179.943 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -163.4 -60.92 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.489 -179.931 . . . . . . . . 1 1 . 1 . 085 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 51.52 59.51 4.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.528 179.97 . . . . . . . . 2 2 . 1 . 085 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.33 -0.262 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.022 -179.954 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.342 0 N-CA-C 111.892 -0.483 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 086 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.407 ' C ' ' H ' ' A' ' 4' ' ' LYS . 39.9 ttm180 -169.48 -27.77 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.788 0.328 . . . . 0.0 110.538 -179.988 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -76.41 40.04 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.631 179.987 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.407 ' H ' ' C ' ' A' ' 2' ' ' ARG . 17.2 tptp -168.63 -21.56 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.491 179.973 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 24.8 mmt180 -59.61 -64.29 1.0 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.424 179.892 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.492 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 78.7 mttt -145.53 59.42 1.27 Allowed 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.094 -180.0 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 97.5 m95 -159.89 2.24 0.08 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.02 -179.887 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -49.38 -85.07 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.174 -179.919 . . . . . . . . 3 3 . 1 . 086 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.88 18.47 0.19 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.691 0.281 . . . . 0.0 110.902 179.784 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 -44.66 -89.38 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 179.394 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.3 tp -77.39 -19.33 14.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 179.14 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.85 -38.93 90.61 Favored Glycine 0 N--CA 1.449 -0.44 0 N-CA-C 111.412 -0.675 . . . . 0.0 111.412 179.548 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.1 ttpt -48.34 -17.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.113 0.483 . . . . 0.0 110.042 179.084 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.448 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -99.24 -43.36 2.58 Favored Glycine 0 C--N 1.335 0.496 0 CA-C-N 115.78 -0.646 . . . . 0.0 112.36 -179.834 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.7 m -105.12 -42.45 7.14 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 116.845 0.323 . . . . 0.0 110.999 -179.517 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . 81.4 tttt -59.8 -40.35 88.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.74 0.305 . . . . 0.0 110.43 -179.922 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.515 HG23 ' N ' ' A' ' 18' ' ' ILE . 17.1 tt -50.19 -43.32 21.25 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.555 -179.943 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.515 ' N ' HG23 ' A' ' 17' ' ' ILE . 13.7 mt -69.53 -65.04 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.107 179.74 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 173.64 52.26 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.606 -0.598 . . . . 0.0 111.606 179.884 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 85.77 -50.04 4.24 Favored Glycine 0 C--N 1.333 0.373 0 N-CA-C 111.715 -0.554 . . . . 0.0 111.715 -179.753 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.98 31.74 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 -179.705 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 61.14 40.55 14.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 106.716 -1.587 . . . . 0.0 106.716 -177.403 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.518 HD12 ' N ' ' A' ' 23' ' ' LEU . 8.4 mp 56.58 21.36 5.66 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.222 . . . . . . . . 2 2 . 1 . 086 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 2.1 p30 42.73 37.52 1.07 Allowed 'General case' 0 C--O 1.231 0.11 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.972 -179.097 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.5 t-80 -50.31 137.28 18.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.249 -1.341 . . . . 0.0 110.664 179.852 . . . . . . . . 1 1 . 1 . 086 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 19.4 mt . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.453 179.99 . . . . . . . . 0 0 . 1 . 087 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 111.91 -0.476 . . . . 0.0 111.91 . . . . . . . . . 0 0 . 1 . 087 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.7 mtp180 -64.53 -3.26 2.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.808 0.337 . . . . 0.0 110.511 -179.994 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 50.6 mtp85 -58.93 -37.82 77.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.555 179.97 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -129.08 138.16 51.69 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.256 179.999 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -49.27 -72.49 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.65 -179.91 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.1 mttm -145.94 77.3 1.49 Allowed 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.334 -179.98 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.457 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 58.1 t-105 -161.55 -8.17 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.293 -179.96 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.653 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.9 pt? -57.12 -159.67 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.874 179.924 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.17 30.03 0.4 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.123 0.487 . . . . 0.0 110.125 -179.867 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.409 ' H ' ' C ' ' A' ' 8' ' ' LEU . 10.7 ptt85 -38.53 -37.4 0.31 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.473 179.305 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.7 tt -137.24 -16.81 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 178.949 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -58.66 -27.82 61.92 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 114.897 -1.047 . . . . 0.0 110.818 179.059 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -54.45 -22.9 13.95 Favored 'General case' 0 C--N 1.334 -0.076 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.17 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -91.64 -46.97 3.58 Favored Glycine 0 C--N 1.332 0.309 0 N-CA-C 110.957 -0.857 . . . . 0.0 110.957 179.26 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 46.7 t -92.6 -72.75 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 CA-C-O 120.618 0.247 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.495 ' O ' ' N ' ' A' ' 18' ' ' ILE . 34.1 ttmt -35.79 -35.75 0.07 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.333 -179.252 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.4 tt -45.56 -14.35 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.314 0 CA-C-O 120.731 0.3 . . . . 0.0 111.463 -179.581 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.495 ' N ' ' O ' ' A' ' 16' ' ' LYS . 17.9 tt -155.54 -26.85 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.707 0.289 . . . . 0.0 110.547 179.783 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.02 4.08 33.47 Favored Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 179.78 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.438 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -161.61 -36.71 0.02 OUTLIER Glycine 0 C--N 1.33 0.238 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 179.947 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.71 8.08 1.64 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.95 0.405 . . . . 0.0 110.076 179.594 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.438 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -159.25 -39.92 0.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.157 -179.943 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 5.4 tp -78.91 27.94 0.22 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.077 179.805 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 22' ' ' ALA . 22.7 t70 -165.62 -26.63 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.342 -179.956 . . . . . . . . 2 2 . 1 . 087 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 58.79 105.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.684 179.838 . . . . . . . . 1 1 . 1 . 087 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.423 HD23 ' C ' ' A' ' 26' ' ' LEU . 1.5 tt . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.155 179.929 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.007 -0.437 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 088 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -79.09 60.78 3.06 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.891 0.377 . . . . 0.0 110.604 179.967 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 76.3 mtp180 -54.89 -45.51 74.69 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.545 -179.982 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' O ' ' N ' ' A' ' 6' ' ' LYS . 18.4 pttm -156.72 62.09 0.53 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.469 -179.924 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 60.4 -76.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.978 179.858 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 4' ' ' LYS . 81.8 mttt -142.45 -170.15 3.13 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.754 0.311 . . . . 0.0 110.463 -179.857 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.592 ' CE2' ' NH2' ' A' ' 9' ' ' ARG . 2.0 t90 69.2 -0.12 2.62 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.249 179.396 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.473 ' N ' HD23 ' A' ' 8' ' ' LEU . 0.8 OUTLIER -71.26 12.93 0.26 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 120.886 -0.326 . . . . 0.0 111.436 -179.727 . . . . . . . . 3 3 . 1 . 088 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.592 ' NH2' ' CE2' ' A' ' 7' ' ' TRP . 4.3 mmt-85 61.41 45.48 8.47 Favored 'General case' 0 CA--C 1.521 -0.149 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.136 179.854 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.9 ptt-85 -51.04 -86.83 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.699 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.5 pp -92.5 -7.73 10.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 178.383 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.508 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -62.59 -37.06 94.12 Favored Glycine 0 C--N 1.336 0.582 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 179.382 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.417 ' NZ ' ' CB ' ' A' ' 13' ' ' LYS . 5.2 ttpm? -49.33 -15.64 0.14 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.959 0.409 . . . . 0.0 109.916 178.793 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.452 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -102.4 -42.39 2.2 Favored Glycine 0 C--N 1.337 0.599 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.571 -179.651 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -105.62 -40.36 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.683 0 CA-C-N 116.823 0.311 . . . . 0.0 110.893 -179.529 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.508 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.9 tptt -67.93 -32.53 73.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.657 -179.911 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.53 HG23 ' H ' ' A' ' 18' ' ' ILE . 2.5 tp -47.02 -55.47 1.81 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.521 -179.811 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.53 ' H ' HG23 ' A' ' 17' ' ' ILE . 25.3 mt -89.31 -72.92 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.342 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.435 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -172.18 -14.78 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.049 -0.595 . . . . 0.0 112.077 -179.988 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 74.71 -34.22 1.01 Allowed Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 121.207 -0.52 . . . . 0.0 112.009 -179.985 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.435 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -50.16 -44.56 52.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.87 0.367 . . . . 0.0 110.234 179.875 . . . . . . . . 2 2 . 1 . 088 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.06 -47.98 63.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.076 179.588 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.6 mt -79.83 39.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -165.77 -74.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.555 -179.951 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 68.0 m80 -76.49 84.44 3.2 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.536 -179.977 . . . . . . . . 1 1 . 1 . 088 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.492 179.817 . . . . . . . . 0 0 . 1 . 089 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.332 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 089 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.9 mtt-85 -64.63 80.23 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.803 0.335 . . . . 0.0 110.508 179.981 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.437 ' C ' ' H ' ' A' ' 5' ' ' ARG . 41.9 ttp180 -74.2 -61.92 1.69 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.637 -179.898 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.502 ' O ' ' N ' ' A' ' 6' ' ' LYS . 86.2 mttt -78.25 30.96 0.18 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.621 -179.967 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.437 ' H ' ' C ' ' A' ' 3' ' ' ARG . 84.6 mtm180 54.15 -83.85 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.744 179.99 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.502 ' N ' ' O ' ' A' ' 4' ' ' LYS . 88.5 mttt -141.82 74.28 1.45 Allowed 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.276 -179.891 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.474 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 73.5 t-105 -169.72 13.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.469 -179.954 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.551 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -73.58 -87.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.103 -0.498 . . . . 0.0 109.89 179.739 . . . . . . . . 3 3 . 1 . 089 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.5 tpp85 -168.27 25.91 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.355 179.94 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 7.3 ptt180 -47.5 -90.39 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.744 179.4 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.2 pt -85.46 -14.62 10.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 179.272 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -53.64 -44.87 68.99 Favored Glycine 0 C--N 1.331 0.287 0 N-CA-C 111.323 -0.711 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -45.39 -17.1 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 120.962 0.411 . . . . 0.0 110.327 178.925 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.481 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -101.97 -42.55 2.24 Favored Glycine 0 C--N 1.336 0.578 0 CA-C-N 115.791 -0.64 . . . . 0.0 112.792 -179.725 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.7 m -104.2 -40.26 6.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 CA-C-N 117.226 0.513 . . . . 0.0 111.175 -179.364 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.462 ' N ' ' O ' ' A' ' 12' ' ' GLY . 53.1 tttp -56.53 -58.05 9.73 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.807 0.337 . . . . 0.0 110.658 -179.776 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.3 tt -77.41 20.83 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 CA-C-O 121.173 0.511 . . . . 0.0 110.342 -179.675 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.415 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.5 mt 58.92 100.38 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.28 -179.976 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.07 -116.85 0.39 Allowed Glycine 0 N--CA 1.451 -0.352 0 N-CA-C 111.62 -0.592 . . . . 0.0 111.62 -179.963 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.569 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 53.18 175.13 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.804 -0.712 . . . . 0.0 111.829 179.644 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.525 ' O ' ' HB3' ' A' ' 22' ' ' ALA . . . -60.41 -1.7 0.39 Allowed 'General case' 0 C--N 1.333 -0.141 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 178.367 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.569 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . 100.52 79.35 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.807 -1.088 . . . . 0.0 109.758 -179.925 . . . . . . . . 2 2 . 1 . 089 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 20.7 mt 45.46 49.04 10.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.094 -179.157 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -159.13 3.29 0.09 Allowed 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.311 -1.313 . . . . 0.0 107.774 -179.41 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 10.3 t60 -78.21 -70.77 0.46 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.096 -1.411 . . . . 0.0 110.948 -179.058 . . . . . . . . 1 1 . 1 . 089 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.578 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.0 mp . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.1 -179.797 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 111.932 -0.467 . . . . 0.0 111.932 . . . . . . . . . 0 0 . 1 . 090 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 28.8 ptt85 -167.36 52.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.763 0.316 . . . . 0.0 110.363 -179.965 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 49.5 mtt85 -66.43 -25.22 66.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.71 -179.96 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.497 ' O ' ' N ' ' A' ' 6' ' ' LYS . 82.9 tttt -163.86 61.67 0.16 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.429 -179.672 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 72.3 mtp180 40.41 -91.33 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.112 179.878 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' N ' ' O ' ' A' ' 4' ' ' LYS . 43.3 mtmt -115.9 170.56 8.38 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.934 179.598 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.46 ' C ' ' H ' ' A' ' 9' ' ' ARG . 1.9 m0 61.45 9.78 2.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.948 179.786 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.635 HD23 ' H ' ' A' ' 8' ' ' LEU . 1.8 pt? -72.62 22.68 0.06 Allowed 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.508 -0.315 . . . . 0.0 111.394 -179.934 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.46 ' H ' ' C ' ' A' ' 7' ' ' TRP . 0.8 OUTLIER 52.64 48.19 23.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.154 0.502 . . . . 0.0 110.005 -179.982 . . . . . . . . 3 3 . 1 . 090 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.5 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 8.4 ptm180 -57.91 -55.67 31.91 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.17 179.644 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.5 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 15.1 tt -119.97 -16.34 7.14 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.289 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 178.874 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.494 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.64 -34.36 60.44 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 110.874 -0.89 . . . . 0.0 110.874 178.938 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -49.66 -18.65 0.48 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.267 0.556 . . . . 0.0 109.814 178.989 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.434 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -98.91 -47.67 1.87 Allowed Glycine 0 C--N 1.332 0.359 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.358 -179.731 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.1 m -99.29 -41.06 9.41 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-N 116.997 0.399 . . . . 0.0 111.366 -179.457 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.494 ' N ' ' O ' ' A' ' 12' ' ' GLY . 8.6 tmtm? -61.08 -36.26 79.17 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.492 -0.483 . . . . 0.0 109.943 179.974 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.66 -2.14 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 CA-C-O 121.044 0.45 . . . . 0.0 110.104 179.672 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.47 ' H ' ' C ' ' A' ' 16' ' ' LYS . 10.0 mt 63.84 84.31 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.251 -179.78 . . . . . . . . 2 2 . 1 . 090 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -160.46 25.32 0.28 Allowed Glycine 0 C--N 1.331 0.256 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.784 179.996 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -174.71 -46.45 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 121.149 -0.548 . . . . 0.0 111.871 179.981 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -51.97 -63.91 0.98 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.815 0.341 . . . . 0.0 110.379 179.978 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.77 -40.29 91.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.347 179.933 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 16.3 mt -79.89 43.37 0.59 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.535 179.893 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -163.98 -32.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.634 -179.965 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 13.1 t60 54.84 105.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.589 -179.917 . . . . . . . . 1 1 . 1 . 090 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.403 ' C ' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.358 -179.986 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 091 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 26.2 ttm180 58.9 52.11 6.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.87 0.367 . . . . 0.0 110.293 -179.901 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 58.4 mtp85 -74.85 -24.08 58.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.578 -179.921 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 15.4 pttm -164.2 79.69 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.387 -179.88 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 54.71 -91.66 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.727 179.889 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt -167.73 91.36 0.35 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.065 0.46 . . . . 0.0 110.596 -179.764 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.423 ' C ' ' H ' ' A' ' 9' ' ' ARG . 38.4 t90 -162.4 -4.85 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.152 179.708 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' N ' HD23 ' A' ' 8' ' ' LEU . 1.0 OUTLIER -69.81 8.79 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 179.986 . . . . . . . . 3 3 . 1 . 091 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.423 ' H ' ' C ' ' A' ' 7' ' ' TRP . 13.3 mmt85 62.91 45.54 5.44 Favored 'General case' 0 CA--C 1.521 -0.138 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.076 179.688 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' CZ ' ' CB ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -51.14 -88.05 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 178.566 . . . . . . . . 3 3 . 1 . 091 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 2.4 pp -98.37 -3.43 9.76 Favored 'Isoleucine or valine' 0 C--O 1.232 0.18 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 178.142 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.498 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -62.93 -34.95 91.3 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 178.822 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 9.2 ttmm -51.04 -21.47 1.84 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.061 -0.57 . . . . 0.0 109.767 178.733 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -95.28 -36.4 5.43 Favored Glycine 0 C--N 1.333 0.413 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.636 -179.508 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.417 HG23 ' N ' ' A' ' 16' ' ' LYS . 18.6 m -115.7 -44.88 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.055 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' N ' ' O ' ' A' ' 12' ' ' GLY . 35.4 ttmt -53.65 -54.11 42.42 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.805 -179.381 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.9 tt -69.01 5.55 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 -179.84 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.452 ' H ' ' C ' ' A' ' 16' ' ' LYS . 16.5 mt 60.47 81.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.316 179.978 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -74.46 83.11 0.78 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 121.167 -0.539 . . . . 0.0 112.026 -179.973 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.437 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -54.98 -14.69 5.82 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.11 -0.566 . . . . 0.0 111.838 179.93 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -76.65 19.61 0.27 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 179.947 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.437 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -162.05 -46.02 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.316 -179.958 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.3 mt -80.2 57.59 2.78 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.458 179.861 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.428 ' C ' ' H ' ' A' ' 26' ' ' LEU . 26.0 t0 -167.67 2.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.557 179.996 . . . . . . . . 2 2 . 1 . 091 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.9 m-70 -76.37 20.28 0.22 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.647 179.921 . . . . . . . . 1 1 . 1 . 091 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.491 ' N ' ' CD2' ' A' ' 26' ' ' LEU . 2.5 mm? . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.058 -179.965 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.286 0 N-CA-C 111.955 -0.458 . . . . 0.0 111.955 . . . . . . . . . 0 0 . 1 . 092 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -168.28 50.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.918 0.389 . . . . 0.0 110.249 -179.945 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 23.2 mtp-105 -78.63 -13.19 59.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.661 -179.89 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' O ' ' N ' ' A' ' 6' ' ' LYS . 39.8 mttm -145.3 50.24 1.23 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.527 -179.903 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 78.9 mtt-85 51.04 -86.78 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.981 179.669 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.498 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 51.5 mtmt -141.79 71.97 1.37 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.418 -179.709 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' CD1' ' O ' ' A' ' 6' ' ' LYS . 5.0 m-90 -159.89 10.25 0.11 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.522 179.885 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.793 HD22 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.32 -70.48 0.09 Allowed 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.93 . . . . . . . . 3 3 . 1 . 092 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.12 18.59 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.11 179.766 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.9 ptm85 -39.32 -90.21 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.438 179.761 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.578 HD12 ' N ' ' A' ' 12' ' ' GLY . 1.8 pp -94.2 0.29 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.394 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 178.748 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.578 ' N ' HD12 ' A' ' 11' ' ' ILE . . . -65.46 -41.66 96.24 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 110.984 -0.847 . . . . 0.0 110.984 179.217 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.401 ' O ' HD11 ' A' ' 17' ' ' ILE . 32.1 ttpt -47.06 -18.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.133 0.492 . . . . 0.0 110.215 179.155 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -96.46 -40.39 3.94 Favored Glycine 0 C--N 1.334 0.44 0 CA-C-N 115.738 -0.664 . . . . 0.0 112.315 -179.957 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.6 m -111.1 -42.04 4.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-N 116.814 0.307 . . . . 0.0 111.745 -179.181 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 12' ' ' GLY . 58.7 tttp -49.07 -61.77 1.89 Allowed 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.93 -0.308 . . . . 0.0 111.188 -179.412 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.401 HD11 ' O ' ' A' ' 13' ' ' LYS . 23.9 pt -73.39 15.83 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.893 -179.765 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.442 ' H ' ' C ' ' A' ' 16' ' ' LYS . 15.7 mt 59.41 108.69 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.383 -0.372 . . . . 0.0 110.389 179.975 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -164.49 -94.33 0.1 OUTLIER Glycine 0 C--N 1.33 0.21 0 C-N-CA 121.289 -0.481 . . . . 0.0 111.91 -179.906 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.444 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -67.54 -161.46 1.57 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.012 -179.912 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 54.73 9.7 0.3 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.997 0.427 . . . . 0.0 110.302 -179.704 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.444 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.33 -58.74 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.179 -179.955 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 17.7 mt -93.67 58.5 2.71 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.413 179.693 . . . . . . . . 1 1 . 1 . 092 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.443 ' H ' ' H ' ' A' ' 25' ' ' HIS . 18.9 t70 -166.42 0.57 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.549 -179.991 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.443 ' H ' ' H ' ' A' ' 24' ' ' ASP . 10.0 p80 -54.11 140.15 32.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.596 179.96 . . . . . . . . 2 2 . 1 . 092 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.591 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.8 mp . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.061 -179.998 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.925 -0.47 . . . . 0.0 111.925 . . . . . . . . . 0 0 . 1 . 093 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -75.19 -11.02 59.99 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.851 0.357 . . . . 0.0 110.58 -179.986 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.537 HH22 HH22 ' A' ' 9' ' ' ARG . 89.4 mtm180 53.65 -101.17 0.11 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 093 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -102.37 48.82 0.86 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.71 -179.763 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 91.9 mtm180 51.92 -98.22 0.07 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.795 179.686 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.503 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 93.6 mttt -141.08 80.87 1.76 Allowed 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.064 -179.943 . . . . . . . . 2 2 . 1 . 093 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' CG ' ' O ' ' A' ' 6' ' ' LYS . 89.2 m95 -159.45 -10.23 0.06 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.493 -179.829 . . . . . . . . 2 2 . 1 . 093 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.619 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -53.02 -92.44 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -180.0 . . . . . . . . 3 3 . 1 . 093 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.537 HH22 HH22 ' A' ' 3' ' ' ARG . 0.0 OUTLIER -171.61 22.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.866 179.835 . . . . . . . . 3 3 . 1 . 093 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 ptp180 -44.73 -89.81 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 179.77 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.1 tp -80.19 -17.18 12.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.947 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.535 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -58.92 -37.1 90.51 Favored Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 179.11 . . . . . . . . 2 2 . 1 . 093 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -50.64 -17.98 0.62 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 178.747 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.41 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -94.93 -43.65 3.51 Favored Glycine 0 C--N 1.334 0.461 0 CA-C-N 115.582 -0.735 . . . . 0.0 112.268 -179.859 . . . . . . . . 2 2 . 1 . 093 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 16.1 m -107.11 -43.53 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 CA-C-N 116.704 0.252 . . . . 0.0 110.994 -179.53 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.535 ' N ' ' O ' ' A' ' 12' ' ' GLY . 39.8 tptt -57.57 -33.32 68.04 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.374 -179.93 . . . . . . . . 2 2 . 1 . 093 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.8 tp -58.26 -6.58 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 CA-C-O 121.227 0.537 . . . . 0.0 109.724 179.614 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.456 ' H ' ' C ' ' A' ' 16' ' ' LYS . 7.0 mt 67.47 82.22 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.239 179.887 . . . . . . . . 2 2 . 1 . 093 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -170.85 -54.27 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.864 179.932 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -67.06 -38.11 92.29 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 121.289 -0.481 . . . . 0.0 111.973 -179.972 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.03 -48.83 67.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.782 0.325 . . . . 0.0 110.595 -179.952 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.59 -17.26 63.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.627 -179.974 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 6.2 tp -64.14 -16.5 62.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.217 -179.965 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -158.6 61.26 0.43 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.405 -179.977 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.1 p80 -53.92 154.22 4.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.599 179.999 . . . . . . . . 1 1 . 1 . 093 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.537 ' N ' HD12 ' A' ' 26' ' ' LEU . 7.6 mp . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.094 179.976 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 111.941 -0.464 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 094 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.9 ptm180 -166.26 128.73 1.92 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.877 0.37 . . . . 0.0 110.635 179.97 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.466 ' CD ' ' N ' ' A' ' 3' ' ' ARG . 11.2 mpt_? -92.72 -50.21 5.7 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.046 179.998 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -145.29 -10.64 0.55 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.242 -179.866 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 59.18 115.06 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.93 179.809 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' O ' ' CG ' ' A' ' 7' ' ' TRP . 50.7 mtmt 46.53 43.1 11.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.343 179.457 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.641 ' H ' HD23 ' A' ' 8' ' ' LEU . 2.4 m-90 -168.3 11.07 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 179.276 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.641 HD23 ' H ' ' A' ' 7' ' ' TRP . 0.2 OUTLIER -82.02 -10.58 59.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.796 179.928 . . . . . . . . 3 3 . 1 . 094 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.6 mmt85 65.62 32.95 8.84 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.084 179.557 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.9 ptt180 -45.44 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.634 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.5 tt -87.0 -16.22 9.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.781 179.036 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.507 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -55.42 -37.45 66.28 Favored Glycine 0 C--N 1.332 0.328 0 C-N-CA 121.045 -0.597 . . . . 0.0 111.697 179.689 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -50.31 -15.06 0.2 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.953 0.406 . . . . 0.0 110.064 179.389 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.437 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.42 -43.2 1.89 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-N 115.842 -0.617 . . . . 0.0 112.47 -179.912 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.5 m -104.8 -39.92 5.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-N 116.862 0.331 . . . . 0.0 111.042 -179.514 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.507 ' N ' ' O ' ' A' ' 12' ' ' GLY . 19.6 tptp -68.46 -31.86 71.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.434 179.962 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.4 tt -49.57 -24.81 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.677 -179.802 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 5.4 mm -138.5 -73.2 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 179.405 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.418 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . -179.32 -20.37 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.197 -179.984 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.442 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . 75.61 -20.88 2.09 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 121.164 -0.541 . . . . 0.0 111.944 179.997 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.418 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -65.57 1.13 1.31 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.935 0.397 . . . . 0.0 110.486 179.89 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.442 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -140.08 -48.32 0.45 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.092 179.902 . . . . . . . . 2 2 . 1 . 094 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 10.8 tp -77.06 64.2 2.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.183 179.765 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 32.7 t0 -166.9 -8.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.695 -179.856 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 11.8 t60 -70.65 -45.45 65.13 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.612 -179.847 . . . . . . . . 1 1 . 1 . 094 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.456 -179.994 . . . . . . . . 0 0 . 1 . 095 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 111.972 -0.451 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 095 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.1 mmt180 -69.14 2.4 2.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.752 0.311 . . . . 0.0 110.529 179.94 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 51.3 mtp85 -56.32 -16.11 5.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.499 179.956 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -146.4 141.02 26.76 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.25 179.714 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.3 mtt85 -50.21 -66.9 0.31 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.845 -179.673 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 77.4 mttt -144.14 76.88 1.53 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.56 -179.703 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 66.0 t-105 -171.24 7.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.306 179.783 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -65.23 -86.85 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.999 -0.546 . . . . 0.0 109.905 179.746 . . . . . . . . 3 3 . 1 . 095 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.63 12.52 0.53 Allowed 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.924 0.392 . . . . 0.0 110.502 179.61 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.544 ' CG ' ' H ' ' A' ' 11' ' ' ILE . 16.8 ptt85 -43.06 -60.12 1.76 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.096 179.846 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.544 ' H ' ' CG ' ' A' ' 10' ' ' ARG . 1.2 mm -116.02 -16.25 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 179.353 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.509 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -57.24 -34.62 67.78 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.021 179.252 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -54.2 -12.48 0.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 178.966 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.437 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -103.21 -46.93 1.38 Allowed Glycine 0 C--N 1.333 0.397 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.995 -179.964 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.2 m -101.19 -39.03 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 116.716 0.258 . . . . 0.0 111.041 -179.624 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.509 ' N ' ' O ' ' A' ' 12' ' ' GLY . 82.0 tttt -69.71 -25.6 63.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.916 -179.778 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.7 tt -43.53 -23.57 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-O 120.774 0.321 . . . . 0.0 111.278 -179.939 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.521 HG23 ' N ' ' A' ' 19' ' ' GLY . 16.1 tt -156.17 -43.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.255 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.541 -179.976 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.521 ' N ' HG23 ' A' ' 18' ' ' ILE . . . 166.85 -20.55 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.177 -0.535 . . . . 0.0 111.842 -179.935 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 75.17 -21.74 1.7 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.238 -0.506 . . . . 0.0 111.975 -179.952 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.438 ' H ' ' C ' ' A' ' 19' ' ' GLY . . . -68.01 -46.95 69.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.821 0.343 . . . . 0.0 110.323 179.908 . . . . . . . . 2 2 . 1 . 095 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.89 -38.81 44.98 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.468 179.888 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 12.2 tp -76.04 70.14 2.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.416 -179.938 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 29.7 p30 -173.16 -10.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 3.1 p-80 -51.08 156.09 1.13 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.554 -179.891 . . . . . . . . 1 1 . 1 . 095 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.599 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.194 -179.964 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 N-CA-C 111.927 -0.469 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 096 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 77.5 mtt85 -56.18 120.59 7.78 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.771 0.319 . . . . 0.0 110.587 179.977 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.0 ttt-85 -165.46 -39.24 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.393 179.923 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -120.66 45.15 2.3 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.836 179.89 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.7 tpp180 47.99 42.85 17.25 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.466 -179.778 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 50.95 81.2 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.474 -179.839 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.429 ' CG ' ' O ' ' A' ' 7' ' ' TRP . 73.1 t-105 -166.13 14.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.739 -179.836 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.499 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -77.39 -93.59 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.214 179.824 . . . . . . . . 3 3 . 1 . 096 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.462 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 32.2 mmt-85 -141.41 14.67 2.19 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.811 -179.327 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG3' ' H ' ' A' ' 11' ' ' ILE . 4.5 ptm180 -47.48 -87.77 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 178.822 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.402 ' H ' ' HG3' ' A' ' 10' ' ' ARG . 4.2 tp -80.96 -14.36 12.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.04 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.491 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -49.33 -52.21 24.06 Favored Glycine 0 N--CA 1.451 -0.364 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.872 179.736 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 mtmm -44.18 -17.76 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.875 0.369 . . . . 0.0 110.678 179.474 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.491 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -98.71 -31.32 6.4 Favored Glycine 0 C--N 1.332 0.322 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.425 -179.816 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.414 ' N ' ' O ' ' A' ' 12' ' ' GLY . 16.2 m -119.92 -44.02 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 116.967 0.384 . . . . 0.0 111.215 -179.595 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.484 ' N ' ' O ' ' A' ' 12' ' ' GLY . 37.4 tptt -53.64 -57.76 9.63 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.428 -179.894 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 3.1 tp -74.81 14.04 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.361 -179.891 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.419 ' H ' ' C ' ' A' ' 16' ' ' LYS . 13.3 mt 56.68 81.3 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.377 -179.869 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -66.27 98.48 0.38 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.951 179.94 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' A' ' 22' ' ' ALA . . . -66.72 -12.07 58.65 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.085 -0.579 . . . . 0.0 112.075 -179.961 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -72.93 10.89 0.78 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.766 0.317 . . . . 0.0 110.57 179.983 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 20' ' ' GLY . . . -165.25 -45.74 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.48 -179.959 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.567 HD12 ' N ' ' A' ' 23' ' ' LEU . 7.2 mp -78.64 48.51 0.81 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.063 179.971 . . . . . . . . 2 2 . 1 . 096 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -165.1 -55.53 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.505 -179.963 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 14.3 t-80 54.34 77.36 0.2 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.511 -179.992 . . . . . . . . 1 1 . 1 . 096 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.463 0.212 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.389 179.834 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.281 0 N-CA-C 111.94 -0.464 . . . . 0.0 111.94 . . . . . . . . . 0 0 . 1 . 097 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.9 mtm-85 -52.42 130.15 30.62 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.853 0.359 . . . . 0.0 110.513 -179.892 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.41 -36.29 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.356 179.979 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.3 tttp -141.67 53.82 1.51 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.0 0.429 . . . . 0.0 110.005 179.834 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mmt180 48.42 29.31 1.95 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.605 -179.868 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.6 mttm 54.88 95.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.375 -179.776 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.424 ' C ' ' N ' ' A' ' 9' ' ' ARG . 58.1 t90 -164.81 -13.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.646 -179.707 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.544 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -53.95 -12.17 0.54 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.991 . . . . . . . . 3 3 . 1 . 097 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' N ' ' C ' ' A' ' 7' ' ' TRP . 3.3 tpp85 76.08 31.31 0.67 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.356 -179.81 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.1 ptt85 -50.02 -90.73 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.35 -0.386 . . . . 0.0 109.963 179.512 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.8 tt -80.86 -21.83 11.11 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.214 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.91 -40.11 71.26 Favored Glycine 0 N--CA 1.448 -0.5 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.778 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.7 ttpt -50.13 -15.11 0.19 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.189 0.519 . . . . 0.0 109.832 178.947 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' O ' ' N ' ' A' ' 19' ' ' GLY . . . -100.0 -43.04 2.5 Favored Glycine 0 C--N 1.334 0.442 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.53 -179.773 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 15.3 m -104.35 -42.36 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 CA-C-N 117.002 0.401 . . . . 0.0 111.324 -179.437 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' A' ' 12' ' ' GLY . 1.1 tmtm? -52.92 -62.32 1.73 Allowed 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.807 -0.357 . . . . 0.0 110.04 -179.863 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.7 tt -72.09 8.02 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-O 121.164 0.507 . . . . 0.0 109.791 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.454 ' H ' ' C ' ' A' ' 16' ' ' LYS . 6.1 mm 60.94 94.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.018 -179.849 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.46 ' N ' ' O ' ' A' ' 14' ' ' GLY . . . -65.33 138.87 39.06 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.092 -179.834 . . . . . . . . 2 2 . 1 . 097 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.25 -28.02 71.58 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 121.079 -0.581 . . . . 0.0 111.911 179.892 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.58 -55.86 19.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.856 0.36 . . . . 0.0 110.421 179.801 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.1 -46.16 65.41 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.381 179.739 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 11.1 tp -77.97 67.08 3.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.271 179.87 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -166.74 -8.19 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.382 179.985 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.79 -2.64 27.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.481 -179.975 . . . . . . . . 1 1 . 1 . 097 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.2 mt . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.442 179.976 . . . . . . . . 0 0 . 1 . 098 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 111.974 -0.45 . . . . 0.0 111.974 . . . . . . . . . 0 0 . 1 . 098 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.0 mtm180 -149.74 -37.41 0.15 Allowed 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.855 0.359 . . . . 0.0 110.212 179.918 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 74.9 mtp180 51.15 -100.9 0.09 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.699 179.95 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.7 mttt -83.88 -78.25 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.748 -0.205 . . . . 0.0 110.628 -179.737 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 55.5 ttt180 -173.39 -56.06 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.745 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.41 ' C ' ' H ' ' A' ' 8' ' ' LEU . 70.0 mmtt -133.69 156.63 47.57 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.727 179.54 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.42 ' O ' ' CD1' ' A' ' 7' ' ' TRP . 59.7 t-105 60.76 3.2 0.59 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 179.616 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.52 HD23 ' H ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -46.04 -86.59 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.332 0 CA-C-O 120.81 0.338 . . . . 0.0 110.259 179.558 . . . . . . . . 3 3 . 1 . 098 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.432 ' H ' ' CG ' ' A' ' 8' ' ' LEU . 6.1 tpt180 -160.81 25.4 0.14 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.941 179.768 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -49.65 -89.24 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.87 179.613 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.2 pt -85.1 -14.09 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-N 116.585 -0.279 . . . . 0.0 110.308 179.579 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -54.4 -46.69 71.84 Favored Glycine 0 CA--C 1.508 -0.398 0 N-CA-C 110.922 -0.871 . . . . 0.0 110.922 179.748 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -44.84 -20.06 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-O 121.124 0.488 . . . . 0.0 109.773 178.438 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.468 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -91.02 -45.53 4.14 Favored Glycine 0 C--N 1.333 0.417 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.294 179.908 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.439 HG23 ' N ' ' A' ' 16' ' ' LYS . 28.5 m -109.79 -42.46 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 CA-C-N 117.112 0.456 . . . . 0.0 111.135 -179.696 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.523 ' N ' ' O ' ' A' ' 12' ' ' GLY . 80.7 tttt -59.05 -27.35 65.42 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.221 179.955 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 17.0 tt -64.46 -4.03 1.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.867 179.606 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 13.0 mm 63.21 66.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.206 -179.695 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -118.39 51.48 0.75 Allowed Glycine 0 C--N 1.337 0.625 0 N-CA-C 110.763 -0.935 . . . . 0.0 110.763 179.707 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.449 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 65.32 8.08 35.81 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 111.492 -0.643 . . . . 0.0 111.492 -179.445 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 51.54 13.42 0.2 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.053 0.454 . . . . 0.0 110.159 -179.651 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.449 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -163.2 3.84 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.94 179.952 . . . . . . . . 2 2 . 1 . 098 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.0 tp -122.86 55.86 1.17 Allowed 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.552 179.649 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -138.44 -51.25 0.57 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.134 -179.658 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 5.5 m-70 -77.24 101.16 6.11 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.547 179.901 . . . . . . . . 1 1 . 1 . 098 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 26' ' ' LEU . 8.2 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.126 179.962 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.254 0 N-CA-C 111.902 -0.479 . . . . 0.0 111.902 . . . . . . . . . 0 0 . 1 . 099 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 80.2 mtm180 -68.54 85.34 0.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.839 0.352 . . . . 0.0 110.569 179.954 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -59.35 -41.26 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.633 -179.976 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -145.51 47.85 1.27 Allowed 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 -179.721 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.45 66.36 0.53 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.639 -179.93 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 62.1 mttm 56.38 -160.15 0.21 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.636 -179.898 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 96.0 m95 55.15 14.9 1.1 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.873 -179.991 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD12 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -49.43 -70.73 0.08 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.831 0.348 . . . . 0.0 110.079 -179.986 . . . . . . . . 3 3 . 1 . 099 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -167.33 14.89 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.363 -179.896 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.3 ptt180 -42.72 -88.45 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 179.892 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.8 tt -87.22 -13.52 10.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 178.975 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.488 ' O ' ' N ' ' A' ' 16' ' ' LYS . . . -56.88 -36.91 75.23 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 110.786 -0.925 . . . . 0.0 110.786 179.462 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 19.3 ttpp -48.24 -16.09 0.09 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.042 0.449 . . . . 0.0 110.077 178.781 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.44 ' N ' ' C ' ' A' ' 12' ' ' GLY . . . -104.48 -45.26 1.46 Allowed Glycine 0 C--N 1.336 0.537 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.493 -179.83 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 18.4 m -101.41 -39.2 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-N 117.014 0.407 . . . . 0.0 111.198 -179.55 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 12' ' ' GLY . 11.9 ttmm -70.72 -33.43 70.84 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 120.724 -0.39 . . . . 0.0 110.633 -179.857 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 15.7 tt -48.14 -26.57 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.832 0.348 . . . . 0.0 110.444 179.965 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 24.4 mt -135.39 -79.49 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.128 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 160.08 50.95 0.01 OUTLIER Glycine 0 C--N 1.332 0.324 0 N-CA-C 111.804 -0.519 . . . . 0.0 111.804 179.951 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.424 ' C ' ' N ' ' A' ' 22' ' ' ALA . . . 48.67 -137.08 17.38 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 121.195 -0.526 . . . . 0.0 111.834 -179.874 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 50.51 15.08 0.19 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.888 0.375 . . . . 0.0 110.426 179.99 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.424 ' N ' ' C ' ' A' ' 20' ' ' GLY . . . -171.64 -65.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.351 -179.932 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.51 ' CD2' ' N ' ' A' ' 23' ' ' LEU . 2.4 mm? -79.64 59.7 3.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.116 179.821 . . . . . . . . 2 2 . 1 . 099 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -165.9 -9.18 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.641 -179.964 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -68.73 163.99 22.73 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.536 179.98 . . . . . . . . 1 1 . 1 . 099 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.332 -0.169 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.512 179.948 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 N-CA-C 111.962 -0.455 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 100 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.469 ' O ' ' N ' ' A' ' 4' ' ' LYS . 70.3 mtm180 -60.61 -73.27 0.09 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.488 -179.991 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.0 ttt-85 60.33 -77.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.693 -179.948 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' O ' ' N ' ' A' ' 6' ' ' LYS . 49.4 mttm -104.36 38.07 1.96 Allowed 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.68 0.276 . . . . 0.0 110.528 179.928 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 92.3 mtm-85 53.51 -85.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.617 179.934 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.499 ' N ' ' O ' ' A' ' 4' ' ' LYS . 54.4 mttm -145.71 58.29 1.24 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.207 -179.947 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.407 ' C ' ' H ' ' A' ' 9' ' ' ARG . 93.5 m95 -147.39 18.75 1.2 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.683 179.81 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.41 ' CD1' ' H ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -80.35 24.26 0.45 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.652 179.6 . . . . . . . . 3 3 . 1 . 100 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.407 ' H ' ' C ' ' A' ' 7' ' ' TRP . 7.0 tpp180 71.06 33.44 2.06 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.33 179.442 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.6 ptt85 -51.97 -91.9 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.741 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.7 pt -79.75 -11.21 12.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.292 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.502 ' O ' ' N ' ' A' ' 14' ' ' GLY . . . -51.69 -54.39 25.09 Favored Glycine 0 C--N 1.334 0.428 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.607 179.9 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 42.3 mtmt -44.56 -18.05 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.077 0.465 . . . . 0.0 110.026 178.919 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.502 ' N ' ' O ' ' A' ' 12' ' ' GLY . . . -95.09 -32.77 6.91 Favored Glycine 0 C--N 1.334 0.444 0 CA-C-N 115.784 -0.644 . . . . 0.0 112.733 -179.845 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.478 HG23 ' N ' ' A' ' 16' ' ' LYS . 33.1 m -126.9 -42.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 CA-C-N 117.486 0.643 . . . . 0.0 112.008 -179.071 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.478 ' N ' HG23 ' A' ' 15' ' ' VAL . 18.4 mmmt -54.4 -54.46 40.32 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.443 -0.503 . . . . 0.0 110.64 -179.239 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.0 tt -65.56 0.34 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.099 0.476 . . . . 0.0 109.978 179.766 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.444 ' H ' ' C ' ' A' ' 16' ' ' LYS . 11.7 mt 62.51 100.87 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.483 179.809 . . . . . . . . 2 2 . 1 . 100 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -162.42 -74.43 0.02 OUTLIER Glycine 0 C--N 1.33 0.221 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.83 179.997 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -66.55 -29.06 74.16 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.087 -0.578 . . . . 0.0 111.84 179.884 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.18 -58.97 6.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.763 0.316 . . . . 0.0 110.543 179.951 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.55 -38.88 70.97 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.526 179.911 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 9.3 tp -76.09 68.31 2.52 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.463 -179.958 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -166.92 -28.76 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.487 179.922 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 66.3 m80 -67.13 -56.69 8.91 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.455 179.942 . . . . . . . . 1 1 . 1 . 100 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.5 mt . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.437 179.867 . . . . . . . . 0 0 . 1 stop_ save_